-ISIS- 10201511232D 11 11 0 0 0 0 0 0 0 0999 V2000 2.1458 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1458 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -8.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4083 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1667 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 -7.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 M END > CFN99453 > Cinnamic acid > 140-10-3 > 98% > C9H8O2 > 148.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Cinnamic-acid-CFN99453.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 2.1458 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1458 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -8.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4083 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1667 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 -7.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 12 1 0 0 0 0 M END > CFN98198 > Methyl cinnamate > 103-26-4 > 98% > C10H10O2 > 162.19 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Methyl-cinnamate-CFN98198.html $$$$ -ISIS- 10201511232D 13 13 0 0 0 0 0 0 0 0999 V2000 2.1458 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1458 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -8.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4083 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1667 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 -7.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1875 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 M END > CFN98199 > Ethyl cinnamate > 103-36-6 > 98% > C11H12O2 > 176.21 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ethyl-cinnamate-CFN98199.html $$$$ -ISIS- 10201511232D 13 13 0 0 0 0 0 0 0 0999 V2000 2.1458 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1458 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -8.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4083 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1667 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 -7.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1875 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 M END > CFN98195 > Vinyl Cinnamate > 3098-92-8 > 98% > C11H10O2 > 174.2 > White powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Vinyl-Cinnamate-CFN98195.html $$$$ -ISIS- 10201511232D 18 19 0 0 0 0 0 0 0 0999 V2000 2.1458 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1458 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -8.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4083 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1667 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 -7.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1875 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1875 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9458 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7000 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7000 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9458 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 13 1 0 0 0 0 M END > CFN98196 > Benzyl cinnamate > 103-41-3 > 98% > C16H14O2 > 238.28 > White cryst. > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Benzyl-cinnamate-CFN98196.html $$$$ -ISIS- 10201511232D 20 21 0 0 0 0 0 0 0 0999 V2000 2.1458 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1458 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -8.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4083 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1667 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 -7.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1875 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9375 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6917 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6917 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4500 -8.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2083 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2083 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4500 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 15 1 0 0 0 0 M END > CFN97841 > Cinnamyl cinnamate > 122-69-0 > 98% > C18H16O2 > 264.32 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Cinnamyl-cinnamate-CFN97841.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 4.5542 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0625 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7167 -7.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 M END > CFN98179 > p-Hydroxy-cinnamic acid > 7400-08-0 > 98% > C9H8O3 > 164.16 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/p-Hydroxy-cinnamic-acid-CFN98179.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 3.9542 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9542 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -6.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -5.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5125 -5.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0333 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5542 -5.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -5.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5542 -4.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 -6.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 M END > CFN98794 > trans-4-Hydroxycinnamic acid > 501-98-4 > 98% > C9H8O3 > 164.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/trans-4-Hydroxycinnamic-acid-CFN98794.html $$$$ -ISIS- 10201511232D 15 15 0 0 0 0 0 0 0 0999 V2000 4.5542 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0625 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7167 -7.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8792 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8792 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0458 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 M END > CFN98178 > 4-Acetoxycinnamic acid > 15486-19-8 > 98% > C11H10O4 > 206.19 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/4-Acetoxycinnamic-acid-CFN98178.html $$$$ -ISIS- 10201511232D 13 13 0 0 0 0 0 0 0 0999 V2000 4.5542 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0625 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7167 -7.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8792 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 12 13 1 0 0 0 0 M END > CFN98191 > 4-Methoxycinnamic acid > 830-09-1 > 98% > C10H10O3 > 178.18 > White powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/4-Methoxycinnamic-acid-CFN98191.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 4.5542 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0625 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7167 -7.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4042 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2417 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 M END > CFN97218 > p-Coumaric acid ethyl ester > 7362-39-2 > 98% > C11H12O3 > 192.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/p-Coumaric-acid-ethyl-ester-CFN97218.html $$$$ -ISIS- 10201511232D 15 15 0 0 0 0 0 0 0 0999 V2000 4.5542 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0625 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7167 -7.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8792 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4042 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2417 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 12 13 1 0 0 0 0 10 14 1 0 0 0 0 14 15 1 0 0 0 0 M END > CFN98180 > Ethyl 4-methoxycinnamate > 24393-56-4 > 98% > C12H14O3 > 206.24 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ethyl-4-methoxycinnamate-CFN98180.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 4.4917 -6.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4917 -7.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -8.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1917 -7.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1917 -6.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0417 -6.0458 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8917 -6.5375 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.7417 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7417 -5.0667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6458 -8.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -7.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0417 -5.0667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 8 13 1 0 0 0 0 7 14 1 0 0 0 0 M END > CFN99018 > 2,3-dihydroxy-3-(4-hydroxyphenyl)propanoic acid > 100201-57-8 > 98% > C9H10O5 > 198.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/2-3-dihydroxy-3-4-hydroxyphenyl-propanoic-acid-CFN99018.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 4.4583 -7.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4583 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2792 -8.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0958 -7.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2792 -6.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9208 -6.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7417 -7.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5625 -6.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3792 -7.4000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5625 -5.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6375 -8.8208 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9667 -8.1500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5125 -9.7583 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 M CHG 2 12 1 14 -1 M END > CFN98185 > 4-Nitrocinnamic acid > 619-89-6 > 98% > C9H7NO4 > 193.16 > Yellow cryst. > Phenylpropanoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/4-Nitrocinnamic-acid-CFN98185.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 4.4583 -7.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4583 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2792 -8.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0958 -7.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2792 -6.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9208 -6.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7417 -7.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5625 -6.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3792 -7.4000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5625 -5.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6375 -8.8208 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 M END > CFN98184 > 4-Chlorocinnamic acid > 1615-02-7 > 98% > C9H7ClO2 > 182.60 > Cryst. > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/4-Chlorocinnamic-acid-CFN98184.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 4.4583 -7.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4583 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2792 -8.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0958 -7.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2792 -6.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9208 -6.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7417 -7.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5625 -6.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3792 -7.4000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5625 -5.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2833 -5.9792 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 6 12 1 0 0 0 0 M END > CFN98190 > 2-Chlorocinnamic acid > 3752-25-8 > 98% > C9H7ClO2 > 182.61 > White powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/2-Chlorocinnamic-acid-CFN98190.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 4.5542 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0625 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 6 12 1 0 0 0 0 M END > CFN98193 > 2-Hydroxycinnamic acid > 614-60-8 > 98% > C9H8O3 > 164.16 > White powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/2-Hydroxycinnamic-acid-CFN98193.html $$$$ -ISIS- 10201511232D 13 13 0 0 0 0 0 0 0 0999 V2000 4.5542 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0625 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -4.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 6 12 1 0 0 0 0 12 13 1 0 0 0 0 M END > CFN98192 > 2-Methoxycinnamic acid > 6099-03-2 > 98% > C10H10O3 > 178.18 > White powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/2-Methoxycinnamic-acid-CFN98192.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 4.5542 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0625 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7167 -6.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 1 12 1 0 0 0 0 M END > CFN98181 > trans-3-Hydroxycinnamic acid > 14755-02-3 > 98% > C9H8O3 > 164.16 > White powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/trans-3-Hydroxycinnamic-acid-CFN98181.html $$$$ -ISIS- 10201511232D 15 15 0 0 0 0 0 0 0 0999 V2000 4.4917 -6.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4917 -7.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -8.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1917 -7.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1917 -6.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0417 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -6.5375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7417 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7417 -5.0667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6458 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -7.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6458 -5.0667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7958 -6.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 1 12 1 0 0 0 0 8 13 1 6 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 M END > CFN97831 > Cerberic acid B > 1309362-77-3 > 98% > C10H10O5 > 210.18 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Cerberic-acid-B-CFN97831.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 4.5542 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0625 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7167 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 M END > CFN98186 > 4-Methylcinnamic acid > 1866-39-3 > 98% > C10H10O2 > 162.19 > White cryst. > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/4-Methylcinnamic-acid-CFN98186.html $$$$ -ISIS- 10201511232D 15 15 0 0 0 0 0 0 0 0999 V2000 4.5542 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0625 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7333 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7167 -7.9417 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8792 -8.4250 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2333 -7.1042 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -8.7750 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 M END > CFN98188 > trans-4-(Trifluoromethyl)cinnamic acid > 16642-92-5 > 98% > C10H7F3O2 > 216.16 > White cryst. > Phenylpropanoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/trans-4--Trifluoromethyl-cinnamic-acid-CFN98188.html $$$$ -ISIS- 10201511232D 11 11 0 0 0 0 0 0 0 0999 V2000 4.6833 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6833 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -7.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2667 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2667 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0583 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -6.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -5.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 M END > CFN99478 > Cinnamaldehyde > 104-55-2 > 98% > C9H8O > 132.2 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Cinnamaldehyde-CFN99478.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 4.6833 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6833 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -7.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2667 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2667 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0583 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -6.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -5.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0583 -7.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 4 12 1 0 0 0 0 M END > CFN97017 > 3-(2-Hydroxyphenyl)-2-propenal > 60125-23-7 > 98% > C9H8O2 > 148.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-2-Hydroxyphenyl-2-propenal-CFN97017.html $$$$ -ISIS- 10201511232D 13 13 0 0 0 0 0 0 0 0999 V2000 2.1458 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1458 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -8.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4083 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1667 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 -7.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3875 -8.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6333 -8.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 12 13 1 0 0 0 0 M END > CFN90559 > 4-Methoxycinnamaldehyde > 1963-36-6 > 98% > C10H10O2 > 162.19 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/4-Methoxycinnamaldehyde-CFN90559.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 4.6833 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6833 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -7.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2667 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2667 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0583 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -6.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -5.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -7.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -5.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1042 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 M END > CFN98037 > Coniferaldehyde > 20649-42-7 > 98% > C10H10O3 > 178.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Coniferaldehyde-CFN98037.html $$$$ -ISIS- 10201511232D 16 16 0 0 0 0 0 0 0 0999 V2000 4.6833 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6833 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -7.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2667 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2667 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0583 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -6.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -5.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -7.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -5.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1042 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -8.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6833 -9.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 3 15 1 0 0 0 0 15 16 1 0 0 0 0 M END > CFN98038 > Sinapaldehyde > 20649-43-8 > 98% > C11H12O4 > 208.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Sinapaldehyde-CFN98038.html $$$$ -ISIS- 10201511232D 16 17 0 0 0 0 0 0 0 0999 V2000 4.6833 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6833 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -7.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2667 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2667 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0583 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -6.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -5.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -8.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6833 -9.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8167 -6.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2792 -6.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8167 -7.5958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 3 12 1 0 0 0 0 12 13 1 0 0 0 0 1 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 2 1 0 0 0 0 M END > CFN97228 > 3-Methoxy-4,5-methylenedioxycinnamaldehyde > 74683-19-5 > 98% > C11H10O4 > 206.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-Methoxy-4-5-methylenedioxycinnamaldehyde-CFN97228.html $$$$ -ISIS- 10201511232D 13 13 0 0 0 0 0 0 0 0999 V2000 4.1375 -7.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1375 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9083 -8.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6833 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6833 -7.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9083 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4542 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2250 -7.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 -7.2958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3625 -6.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3625 -8.6375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -5.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 1 11 1 0 0 0 0 2 12 1 0 0 0 0 9 13 2 0 0 0 0 M END > CFN92549 > Trans-caffeic acid > 501-16-6 > 98% > C9H8O4 > 180.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Trans-caffeic-acid-CFN92549.html $$$$ -ISIS- 10201511232D 15 15 0 0 0 0 0 0 0 0999 V2000 4.1375 -7.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1375 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9083 -8.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6833 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6833 -7.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9083 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4542 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2250 -7.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 -7.2958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3625 -6.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3625 -8.6375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -5.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5458 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3167 -7.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 1 11 1 0 0 0 0 2 12 1 0 0 0 0 9 13 2 0 0 0 0 14 10 1 0 0 0 0 15 14 1 0 0 0 0 M END > CFN97136 > Ethyl caffeate > 66648-50-8 > 98% > C11H12O4 > 208.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ethyl-caffeate-CFN97136.html $$$$ -ISIS- 10201511232D 13 13 0 0 0 0 0 0 0 0999 V2000 4.4583 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4583 -8.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -8.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0708 -8.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0708 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -6.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -8.7625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8708 -8.7625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8708 -6.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6750 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4875 -6.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2875 -7.3708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4875 -5.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 4 8 1 0 0 0 0 5 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 M END > CFN98940 > 3-(2,4-Dihydroxyphenyl)propionic acid > 5631-68-5 > 98% > C9H10O4 > 182.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-2-4-Dihydroxyphenyl-propionic-acid-CFN98940.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 4.4583 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4583 -8.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -8.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0708 -8.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0708 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -6.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -8.7625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8708 -8.7625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8708 -6.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6750 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4875 -6.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2875 -7.3708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4875 -5.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0917 -6.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 4 8 1 0 0 0 0 5 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 14 1 0 0 0 0 M END > CFN99823 > Methyl 3-(2,4-dihydroxyphenyl)propionate > 17422-90-1 > 98% > C10H12O4 > 196.2 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Methyl-3-2-4-dihydroxyphenyl-propionate-CFN99823.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 4.4917 -6.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4917 -7.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -8.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1917 -7.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1917 -6.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0417 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -6.5375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7417 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7417 -5.0667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6458 -8.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6458 -6.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -7.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 8 14 1 6 0 0 0 M END > CFN99539 > Danshensu > 22681-72-7 > 98% > C9H10O5 > 198.17 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Danshensu-CFN99539.html $$$$ -ISIS- 10201511232D 15 15 0 0 0 0 0 0 0 0999 V2000 4.4917 -6.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4917 -7.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -8.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1917 -7.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1917 -6.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0417 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -6.5375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7417 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7417 -5.0667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6458 -8.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6458 -6.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -7.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -7.5167 0.0000 Na 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 14 9 1 0 0 0 0 9 10 2 0 0 0 0 2 11 1 0 0 0 0 1 12 1 0 0 0 0 8 13 1 6 0 0 0 1 2 2 0 0 0 0 14 15 1 0 0 0 0 G 14 9 ONa M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 14 15 M SBL 1 1 9 M SMT 1 ONa M SBV 1 9 -0.8500 0.4900 M END > CFN99163 > Sodium Danshensu > 67920-52-9 > 98% > C9H9O5Na > 220.2 > White cryst. > Phenylpropanoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Sodium-Danshensu-CFN99163.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 4.4917 -6.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4917 -7.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -8.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1917 -7.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1917 -6.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0417 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -6.5375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7417 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7417 -5.0667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6458 -8.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6458 -6.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -7.5167 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 8 14 1 1 0 0 0 M END > CFN99800 > Levodopa > 59-92-7 > 98% > C9H11NO4 > 197.20 > White powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Levodopa-CFN99800.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 3.2583 -8.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2583 -9.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 -10.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8542 -9.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8542 -8.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -8.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2417 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0417 -8.6375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2417 -7.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4625 -10.0167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4625 -8.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6625 -9.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 12 14 1 0 0 0 0 M END > CFN99135 > 3-Hydroxy-4-methoxycinnamic acid > 537-73-5 > 98% > C10H10O4 > 194.18 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-Hydroxy-4-methoxycinnamic-acid-CFN99135.html $$$$ -ISIS- 10201511232D 15 15 0 0 0 0 0 0 0 0999 V2000 4.5417 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5417 -8.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -8.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1375 -8.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1375 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7292 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3250 -7.3500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 -5.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -8.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -6.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -8.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 12 14 1 0 0 0 0 10 15 1 0 0 0 0 M END > CFN92276 > Methyl (E)-3'-hydroxy-4'-methoxycinnamate > 97966-29-5 > 98% > C11H12O4 > 208.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Methyl-E-3-hydroxy-4-methoxycinnamate-CFN92276.html $$$$ -ISIS- 10201511232D 16 16 0 0 0 0 0 0 0 0999 V2000 4.5417 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5417 -8.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -8.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1375 -8.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1375 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7292 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3250 -7.3500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 -5.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -8.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -6.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -8.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9167 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 12 14 1 0 0 0 0 10 15 1 0 0 0 0 15 16 1 0 0 0 0 M END > CFN92337 > Ethyl (E)-3'-hydroxy-4'-methoxycinnamate > 155401-23-3 > 98% > C12H14O4 > 222.2 > Cryst. > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ethyl-E-3-hydroxy-4-methoxycinnamate-CFN92337.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 4.5417 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5417 -8.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -8.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1375 -8.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1375 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7292 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3250 -7.3500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 -5.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -8.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -6.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 M END > CFN99158 > Ferulic acid > 1135-24-6 > 98% > C10H10O4 > 194.19 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ferulic-acid-CFN99158.html $$$$ -ISIS- 10201511232D 16 16 0 0 0 0 0 0 0 0999 V2000 4.4833 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4833 -7.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -7.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0167 -7.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0167 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7792 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5417 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3083 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0750 -6.4000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3083 -5.0708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7208 -7.7208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7208 -5.9542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9542 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8417 -5.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6042 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 10 15 1 0 0 0 0 15 16 1 0 0 0 0 M END > CFN99767 > Ethyl ferulate > 4046-02-0 > 98% > C12H14O4 > 222.24 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ethyl-ferulate-CFN99767.html $$$$ -ISIS- 10201511232D 15 15 0 0 0 0 0 0 0 0999 V2000 4.5417 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5417 -8.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -8.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1375 -8.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1375 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7292 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3250 -7.3500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 -5.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -8.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -6.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -8.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 12 14 1 0 0 0 0 13 15 1 0 0 0 0 M END > CFN98194 > 3,4-Dimethoxycinnamic acid > 2316-26-9 > 98% > C11H12O4 > 208.21 > White powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-4-Dimethoxycinnamic-acid-CFN98194.html $$$$ -ISIS- 10201511232D 16 16 0 0 0 0 0 0 0 0999 V2000 4.4708 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -8.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -8.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -6.4833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9167 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8083 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5875 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3583 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1417 -6.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3583 -5.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -9.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -9.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 1 8 1 0 0 0 0 8 9 1 0 0 0 0 5 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 3 15 1 0 0 0 0 15 16 1 0 0 0 0 M END > CFN92631 > Sinapic acid > 530-59-6 > 98% > C11H12O5 > 224.2 > Cryst. > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Sinapic-acid-CFN92631.html $$$$ -ISIS- 10201511232D 17 17 0 0 0 0 0 0 0 0999 V2000 4.4708 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -8.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -8.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -6.4833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9167 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8083 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5875 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3583 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1417 -6.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3583 -5.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -9.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -9.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 1 8 1 0 0 0 0 8 9 1 0 0 0 0 5 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 13 15 1 0 0 0 0 3 16 1 0 0 0 0 16 17 1 0 0 0 0 M END > CFN97787 > Methyl sinapate > 20733-94-2 > 98% > C12H14O5 > 238.24 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Methyl-sinapate-CFN97787.html $$$$ -ISIS- 10201511232D 17 17 0 0 0 0 0 0 0 0999 V2000 4.4708 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -8.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -8.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -6.4833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9167 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8083 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5875 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3583 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1417 -6.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3583 -5.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -9.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -9.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9167 -7.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 1 8 1 0 0 0 0 8 9 1 0 0 0 0 5 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 3 15 1 0 0 0 0 15 16 1 0 0 0 0 7 17 1 0 0 0 0 M END > CFN92506 > 3,4,5-Trimethoxy-trans-cinnamic acid > 20329-98-0 > 98% > C12H14O5 > 238.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-4-5-Trimethoxy-trans-cinnamic-acid-CFN92506.html $$$$ -ISIS- 10201511232D 18 18 0 0 0 0 0 0 0 0999 V2000 4.4708 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -8.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -8.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -6.4833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9167 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8083 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5875 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3583 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1417 -6.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3583 -5.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -9.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -9.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9167 -7.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9208 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 1 8 1 0 0 0 0 8 9 1 0 0 0 0 5 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 3 15 1 0 0 0 0 15 16 1 0 0 0 0 7 17 1 0 0 0 0 13 18 1 0 0 0 0 M END > CFN97691 > Methyl 3,4,5-trimethoxycinnamate > 7560-49-8 > 98% > C13H16O5 > 252.26 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Methyl-3-4-5-trimethoxycinnamate-CFN97691.html $$$$ -ISIS- 10201511232D 17 17 0 0 0 0 0 0 0 0999 V2000 4.4708 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -8.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -8.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -6.4833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9167 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8083 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5875 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3583 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1417 -6.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3583 -5.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9167 -7.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -5.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -5.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 1 8 1 0 0 0 0 8 9 1 0 0 0 0 5 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 7 15 1 0 0 0 0 6 16 1 0 0 0 0 16 17 1 0 0 0 0 M END > CFN98189 > trans-2,3,4-Trimethoxycinnamic acid > 33130-03-9 > 98% > C12H14O5 > 238.24 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/trans-2-3-4-Trimethoxycinnamic-CFN98189.html $$$$ -ISIS- 10201511232D 24 25 0 0 0 0 0 0 0 0999 V2000 5.8042 -8.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8042 -9.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6083 -9.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4083 -9.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4083 -8.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6083 -7.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2167 -9.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0208 -8.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2167 -7.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -7.6333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9000 -6.7125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9917 -6.5167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5292 -7.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1542 -8.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -9.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -9.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -7.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8292 -7.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6250 -8.0958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8292 -6.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5583 -6.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8042 -7.1708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3417 -5.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2375 -5.6208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 8 9 1 0 0 0 0 9 5 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 2 15 1 0 0 0 0 15 16 1 0 0 0 0 10 1 1 0 0 0 0 13 17 2 0 0 0 0 8 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 10 22 1 1 0 0 0 11 21 1 1 0 0 0 12 23 1 1 0 0 0 12 24 1 6 0 0 0 M END > CFN97911 > Secodihydro-hydramicromelin B > 1212148-58-7 > 98% > C15H18O8 > 326.3 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Secodihydro-hydramicromelin-B-CFN97911.html $$$$ -ISIS- 10201511232D 11 11 0 0 0 0 0 0 0 0999 V2000 4.4417 -5.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -6.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9625 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4792 -6.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4792 -5.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9625 -5.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -6.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -5.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5208 -5.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -4.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -5.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 11 1 0 0 0 0 M END > CFN97700 > 1-(4-Hydroxyphenyl)propan-1-one > 70-70-2 > 98% > C9H10O2 > 150.17 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/1-4-Hydroxyphenyl-propan-1-one-CFN97700.html $$$$ -ISIS- 10201511232D 11 11 0 0 0 0 0 0 0 0999 V2000 2.0458 -3.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0458 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8625 -5.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -3.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8625 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4917 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3000 -3.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1083 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2333 -5.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4208 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 2 10 1 0 0 0 0 10 11 1 0 0 0 0 M END > CFN98550 > Anethole > 104-46-1 > 98% > C10H12O > 148.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Anethole-CFN98550.html $$$$ -ISIS- 10201511232D 11 11 0 0 0 0 0 0 0 0999 V2000 4.4417 -5.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -6.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -6.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4792 -6.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4792 -5.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -5.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -5.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5167 -5.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -6.4625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -5.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -5.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 2 9 1 0 0 0 0 1 10 1 0 0 0 0 8 11 2 0 0 0 0 M END > CFN99226 > 4-Allylpyrocatechol > 1126-61-0 > 98% > C9H10O2 > 150.2 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/4-Allylpyrocatechol-CFN99226.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 5.0250 -5.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -6.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8583 -7.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -5.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8583 -5.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5167 -5.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3458 -5.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1958 -7.2917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1958 -5.3750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1750 -5.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3708 -5.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 2 9 1 0 0 0 0 1 10 1 0 0 0 0 8 11 2 0 0 0 0 10 12 1 0 0 0 0 M END > CFN99175 > Eugenol > 97-53-0 > 98% > C10H12O2 > 164.20 > Liquid > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Eugenol-CFN99175.html $$$$ -ISIS- 10201511232D 13 13 0 0 0 0 0 0 0 0999 V2000 4.7292 -5.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -6.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -6.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7667 -6.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7667 -5.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -5.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2875 -5.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8042 -5.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8042 -6.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2083 -6.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6875 -6.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2083 -5.1042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6875 -5.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 8 9 1 0 0 0 0 2 10 1 0 0 0 0 10 11 1 0 0 0 0 1 12 1 0 0 0 0 12 13 1 0 0 0 0 M END > CFN97095 > cis-Methylisoeugenol > 6380-24-1 > 98% > C11H14O2 > 178.2 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/cis-Methylisoeugenol-CFN97095.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 4.5583 -5.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5583 -6.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1625 -6.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1625 -5.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -4.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9667 -4.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7708 -5.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5750 -4.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -4.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -7.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -6.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 -5.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5583 -8.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 1 10 1 0 0 0 0 3 11 1 0 0 0 0 2 12 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 M END > CFN92632 > Syringylpropane > 6766-82-1 > 98% > C11H16O3 > 196.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Syringylpropane-CFN92632.html $$$$ -ISIS- 10201511232D 15 15 0 0 0 0 0 0 0 0999 V2000 5.0000 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7917 -7.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5708 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5708 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7917 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2208 -5.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2208 -7.7000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7917 -8.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -9.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3625 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1458 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9250 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 1 7 1 0 0 0 0 7 8 1 0 0 0 0 2 9 1 0 0 0 0 9 10 1 0 0 0 0 3 11 1 0 0 0 0 11 12 1 0 0 0 0 5 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 M END > CFN97886 > Isoelemicin > 5273-85-8 > 98% > C12H16O3 > 208.3 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Isoelemicin-CFN97886.html $$$$ -ISIS- 10201511232D 15 15 0 0 0 0 0 0 0 0999 V2000 2.9792 -3.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9792 -4.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -4.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0167 -4.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0167 -3.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -3.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5375 -3.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0542 -3.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0542 -4.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -2.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4583 -4.3500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -4.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9792 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9375 -4.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9792 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 8 9 1 0 0 0 0 6 10 1 0 0 0 0 2 11 1 0 0 0 0 3 12 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 12 15 1 0 0 0 0 M END > CFN98870 > beta-Asarone > 5273-86-9 > 98% > C12H16O3 > 208.3 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/beta-Asarone-CFN98870.html $$$$ -ISIS- 10201511232D 15 15 0 0 0 0 0 0 0 0999 V2000 4.5583 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5583 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3708 -9.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1792 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1792 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3708 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9917 -7.2417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7958 -7.7125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6042 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4167 -7.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -9.1125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -7.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9917 -6.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7958 -8.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 2 11 1 0 0 0 0 1 12 1 0 0 0 0 12 13 1 0 0 0 0 8 15 1 1 0 0 0 7 14 1 1 0 0 0 M END > CFN98327 > threo-Guaiacylglycerol > 27391-16-8 > 98% > C10H14O5 > 214.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/threo-Guaiacylglycerol-CFN98327.html $$$$ -ISIS- 10201511232D 15 15 0 0 0 0 0 0 0 0999 V2000 4.5583 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5583 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3708 -9.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1792 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1792 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3708 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9917 -7.2417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7958 -7.7125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6042 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4167 -7.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -9.1125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -7.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9917 -6.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7958 -8.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 2 11 1 0 0 0 0 1 12 1 0 0 0 0 12 13 1 0 0 0 0 8 15 1 1 0 0 0 7 14 1 6 0 0 0 M END > CFN98619 > erythro-Guaiacylglycerol > 38916-91-5 > 98% > C10H14O5 > 214.2 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/erythro-Guaiacylglycerol-CFN98619.html $$$$ -ISIS- 10201511232D 15 15 0 0 0 0 0 0 0 0999 V2000 4.5583 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5583 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3708 -9.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1792 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1792 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3708 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9917 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7958 -7.7125 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.6042 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4167 -7.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -9.1125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -7.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9917 -6.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7958 -8.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 2 11 1 0 0 0 0 1 12 1 0 0 0 0 12 13 1 0 0 0 0 8 15 1 0 0 0 0 7 14 2 0 0 0 0 M END > CFN99804 > C-Veratroylglycol > 168293-10-5 > 98% > C10H12O5 > 212.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/C-Veratroylglycol-CFN99804.html $$$$ -ISIS- 10201511232D 17 17 0 0 0 0 0 0 0 0999 V2000 4.5542 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -7.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -8.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1667 -7.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1667 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -6.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -6.5292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7750 -6.9917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5792 -6.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3833 -6.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -6.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -8.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -9.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -9.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 -7.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -5.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 1 11 1 0 0 0 0 2 12 1 0 0 0 0 3 13 1 0 0 0 0 11 14 1 0 0 0 0 13 15 1 0 0 0 0 7 17 1 6 0 0 0 8 16 1 6 0 0 0 M END > CFN99336 > threo-1-C-Syringylglycerol > 121748-11-6 > 98% > C11H16O6 > 244.2 > Cryst. > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/threo-1-C-Syringylglycerol-CFN99336.html $$$$ -ISIS- 10201511232D 17 17 0 0 0 0 0 0 0 0999 V2000 4.5542 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -7.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -8.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1667 -7.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1667 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -6.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -6.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 -6.9917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5792 -6.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3833 -6.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -6.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -8.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -9.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -9.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 -7.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -5.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 1 11 1 0 0 0 0 2 12 1 0 0 0 0 3 13 1 0 0 0 0 11 14 1 0 0 0 0 13 15 1 0 0 0 0 7 17 2 0 0 0 0 8 16 1 0 0 0 0 M END > CFN98436 > 2,3,4'-Trihydroxy-3',5'-dimethoxypropiophenone > 33900-74-2 > 98% > C11H14O6 > 242.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/2-3-4-Trihydroxy-3-5-dimethoxypropiophenone-CFN98436.html $$$$ -ISIS- 10201511232D 15 15 0 0 0 0 0 0 0 0999 V2000 5.0167 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0167 -8.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8083 -8.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6000 -8.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6000 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8083 -6.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 -8.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -8.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 -6.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3917 -6.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1833 -7.3375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9708 -6.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3917 -5.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1833 -8.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 7 8 1 0 0 0 0 1 9 1 0 0 0 0 9 10 1 0 0 0 0 5 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 11 14 1 1 0 0 0 12 15 1 6 0 0 0 M END > CFN98017 > 1-(3,4-Dimethoxyphenyl)propane-1,2-diol > 20133-19-1 > 98% > C11H16O4 > 212.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/1-3-4-Dimethoxyphenyl-propane-1-2-diol-CFN98017.html $$$$ -ISIS- 10201511232D 14 15 0 0 0 0 0 0 0 0999 V2000 4.5542 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -7.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -8.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1667 -7.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1667 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -6.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -6.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 -6.9917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5792 -6.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3833 -6.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 -7.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6708 -6.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6708 -8.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 8 11 1 0 0 0 0 1 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 2 1 0 0 0 0 M END > CFN97698 > Safrolglycol > 7154-01-0 > 98% > C10H12O4 > 196.20 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Safrolglycol-CFN97698.html $$$$ -ISIS- 10201511232D 16 16 0 0 0 0 0 0 0 0999 V2000 4.5542 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -7.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -8.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1667 -7.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1667 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -6.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -6.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 -6.9917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5792 -6.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3833 -6.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -6.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -8.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -9.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -9.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 -7.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 1 11 1 0 0 0 0 2 12 1 0 0 0 0 3 13 1 0 0 0 0 11 14 1 0 0 0 0 13 15 1 0 0 0 0 8 16 1 0 0 0 0 M END > CFN98231 > 3-(4-Hydroxy-3,5-dimethoxyphenyl)-1,2-propanediol > 22805-15-8 > 98% > C11H16O5 > 228.2 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-4-Hydroxy-3-5-dimethoxyphenyl-1-2-propanediol-CFN98231.html $$$$ -ISIS- 10201511232D 17 17 0 0 0 0 0 0 0 0999 V2000 4.9875 -7.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9875 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7625 -8.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5417 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5417 -7.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7625 -6.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3167 -6.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0958 -7.4208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7625 -6.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2083 -8.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7625 -9.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9875 -5.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9875 -10.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8708 -6.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3167 -6.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0958 -8.3167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 6 9 1 0 0 0 0 2 10 1 0 0 0 0 3 11 1 0 0 0 0 9 12 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 8 15 1 0 0 0 0 7 16 2 0 0 0 0 8 17 1 1 0 0 0 M END > CFN99346 > Tatarinoid A > 1229005-35-9 > 98% > C12H16O5 > 240.3 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Tatarinoid-A-CFN99346.html $$$$ -ISIS- 10201511232D 14 15 0 0 0 0 0 0 0 0999 V2000 4.9958 -7.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9958 -8.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -8.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6250 -8.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6250 -7.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 -7.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5375 -7.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 -8.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4417 -6.9458 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2542 -7.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4417 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6250 -5.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2542 -8.3583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 1 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 2 1 0 0 0 0 5 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 11 14 1 0 0 0 0 M END > CFN99493 > Junipediol B > 144881-19-6 > 98% > C10H12O4 > 196.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Junipediol-B-CFN99493.html $$$$ -ISIS- 10201511232D 10 10 0 0 0 0 0 0 0 0999 V2000 2.0458 -3.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0458 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8625 -5.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -3.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8625 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4917 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3000 -3.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1083 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -3.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 M END > CFN98119 > Cinnamyl alcohol > 104-54-1 > 98% > C9H10O > 134.18 > Cryst. > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Cinnamyl-alcohol-CFN98119.html $$$$ -ISIS- 10201511232D 10 10 0 0 0 0 0 0 0 0999 V2000 3.4667 -5.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4667 -6.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -6.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5083 -6.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5083 -5.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -5.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -5.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5458 -5.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0667 -5.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5875 -5.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 M END > CFN98675 > 3-Phenyl-2-propen-1-ol > 4407-36-7 > 98% > C9H10O > 134.2 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-Phenyl-2-propen-1-ol-CFN98675.html $$$$ -ISIS- 10201511232D 13 13 0 0 0 0 0 0 0 0999 V2000 2.0458 -3.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0458 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8625 -5.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -3.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8625 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4917 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3000 -3.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1083 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -3.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7375 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7375 -2.2708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -3.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 M END > CFN98057 > Cinnamyl acetate > 21040-45-9 > 98% > C11H12O2 > 176.2 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Cinnamyl-acetate-CFN98057.html $$$$ -ISIS- 10201511232D 11 11 0 0 0 0 0 0 0 0999 V2000 4.2625 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2625 -7.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -8.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9292 -7.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9292 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -6.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7625 -6.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5958 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4292 -6.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2625 -6.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 -8.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 2 11 1 0 0 0 0 M END > CFN99037 > 3-(4-Hydroxyphenyl)-1-propanol > 10210-17-0 > 98% > C9H12O2 > 152.2 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-4-Hydroxyphenyl-1-propanol-CFN99037.html $$$$ -ISIS- 10201511232D 11 11 0 0 0 0 0 0 0 0999 V2000 4.2625 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2625 -7.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -8.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9292 -7.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9292 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -6.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7625 -6.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5958 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4292 -6.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2625 -6.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 -8.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 2 11 1 0 0 0 0 M END > CFN96011 > p-Coumaryl alcohol > 3690-05-9 > 98% > C9H10O2 > 150.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/p-Coumaryl-alcohol-CFN96011.html $$$$ -ISIS- 10201511232D 13 14 0 0 0 0 0 0 0 0999 V2000 2.0458 -3.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0458 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8625 -5.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -3.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8625 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4917 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3000 -3.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1083 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -3.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1542 -3.3917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -4.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1542 -4.9125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 1 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 2 1 0 0 0 0 M END > CFN92410 > trans-3,4-Methylenedioxycinnamyl alcohol > 58095-76-4 > 98% > C10H10O3 > 178.2 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/trans-3-4-Methylenedioxycinnamy-l-alcohol-CFN92410.html $$$$ -ISIS- 10201511232D 13 13 0 0 0 0 0 0 0 0999 V2000 1.4542 -3.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4542 -4.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -4.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4917 -4.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4917 -3.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -3.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0125 -3.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5292 -3.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0458 -3.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5667 -3.4042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9375 -4.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9375 -3.1042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4167 -3.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 2 11 1 0 0 0 0 1 12 1 0 0 0 0 12 13 1 0 0 0 0 M END > CFN97760 > Coniferyl alcohol > 32811-40-8 > 98% > C10H12O3 > 180.20 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Coniferyl-alcohol-CFN97760.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 4.5583 -7.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5583 -8.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -8.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -8.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -7.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -6.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9792 -6.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7875 -7.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5917 -6.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4000 -7.3667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9792 -5.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -8.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -6.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -7.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 7 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 M END > CFN98088 > beta-Hydroxypropiovanillone > 2196-18-1 > 98% > C10H12O4 > 196.2 > Cryst. > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/beta-Hydroxypropiovanillone-CFN98088.html $$$$ -ISIS- 10201511232D 16 16 0 0 0 0 0 0 0 0999 V2000 4.5583 -7.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5583 -8.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -8.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -8.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -7.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -6.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9792 -6.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7875 -7.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5917 -6.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4000 -7.3667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9792 -5.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -8.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -6.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -7.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -9.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5583 -10.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 7 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 3 15 1 0 0 0 0 15 16 1 0 0 0 0 M END > CFN97826 > 3,4'-Dihydroxy-3',5'-dimethoxypropiophenone > 136196-47-9 > 98% > C11H14O5 > 226.23 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-4-Dihydroxy-3-5-dimethoxypropiophenone-CFN97826.html $$$$ -ISIS- 10201511232D 16 16 0 0 0 0 0 0 0 0999 V2000 3.9833 -5.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9833 -5.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5042 -6.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -5.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -5.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5042 -4.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5458 -4.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0625 -5.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5833 -4.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1042 -5.1917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4667 -4.8917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5042 -6.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4667 -6.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -5.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9833 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -5.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 1 11 1 0 0 0 0 3 12 1 0 0 0 0 2 13 1 0 0 0 0 11 14 1 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 M END > CFN98379 > 3,4,5-Trimethoxycinnamyl alcohol > 30273-62-2 > 98% > C12H16O4 > 224.3 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-4-5-Trimethoxycinnamyl-alcohol-CFN98379.html $$$$ -ISIS- 10201511232D 16 16 0 0 0 0 0 0 0 0999 V2000 1.7958 -1.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7958 -2.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 -2.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8375 -2.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8375 -1.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 -1.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -1.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -1.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3917 -1.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9125 -1.7333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2708 -2.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7583 -2.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2375 -2.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2833 -2.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8042 -2.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2833 -1.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 2 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 M END > CFN97808 > Evofolin C > 163634-05-7 > 98% > C14H18O2 > 218.29 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Evofolin-C-CFN97808.html $$$$ -ISIS- 10201511232D 17 17 0 0 0 0 0 0 0 0999 V2000 6.9792 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9792 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7875 -7.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5958 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5958 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7875 -5.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4042 -5.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2125 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0208 -5.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8250 -5.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -7.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5583 -7.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 -7.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1333 -6.8208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 2 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 M END > CFN96032 > Cuspidiol > 51593-96-5 > 98% > C14H20O3 > 236.3 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Cuspidiol-CFN96032.html $$$$ -ISIS- 10201511232D 23 23 0 0 0 0 0 0 0 0999 V2000 8.0250 -6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 -7.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7875 -7.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5542 -7.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5542 -6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7875 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3250 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0917 -6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8542 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6208 -6.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2583 -7.6583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 -7.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7208 -7.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 -7.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -7.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 -6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -7.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6625 -7.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -7.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1375 -7.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2583 -5.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 -6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 2 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 1 22 1 0 0 0 0 22 23 1 0 0 0 0 M END > CFN97871 > O-Geranylconiferyl alcohol > 129350-09-0 > 98% > C20H28O3 > 316.4 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/O-Geranylconiferyl-alcohol-CFN97871.html $$$$ -ISIS- 10201511232D 25 25 0 0 0 0 0 0 0 0999 V2000 8.0250 -6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 -7.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7875 -7.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5542 -7.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5542 -6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7875 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3250 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0917 -6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8542 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6208 -6.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2583 -7.6583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 -7.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7208 -7.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 -7.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -7.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 -6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -7.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6625 -7.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -7.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1375 -7.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2583 -5.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 -6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7958 -8.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0333 -8.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 2 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 1 22 1 0 0 0 0 22 23 1 0 0 0 0 3 24 1 0 0 0 0 24 25 1 0 0 0 0 M END > CFN97873 > Nelumol A > 77836-86-3 > 98% > C21H30O4 > 346.5 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Nelumol-A-CFN97873.html $$$$