-ISIS- 10201511232D 11 12 0 0 0 0 0 0 0 0999 V2000 4.6750 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -7.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3375 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3375 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1667 -7.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9958 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9958 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1667 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8250 -7.0833 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 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 M END > CFN99552 > Coumarin > 91-64-5 > 98% > C9H6O2 > 146.15 > White cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Coumarin-CFN99552.html $$$$ -ISIS- 10201511232D 12 13 0 0 0 0 0 0 0 0999 V2000 4.6750 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -7.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3375 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3375 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1667 -7.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9958 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9958 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1667 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8250 -7.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8458 -7.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 M END > CFN97503 > Umbelliferone > 93-35-6 > 98% > C9H6O3 > 162.1 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Umbelliferone-CFN97503.html $$$$ -ISIS- 10201511232D 13 14 0 0 0 0 0 0 0 0999 V2000 2.1500 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -7.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -5.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2958 -5.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4458 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4458 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2958 -7.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -7.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2542 -6.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 -7.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 1 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 2 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 4 13 2 0 0 0 0 M END > CFN90566 > 7-Methoxycoumarin > 531-59-9 > 98% > C10H8O3 > 176.2 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/7-Methoxycoumarin-CFN90566.html $$$$ -ISIS- 10201511232D 14 15 0 0 0 0 0 0 0 0999 V2000 5.5583 -5.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5583 -6.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4083 -6.7208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2583 -6.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2583 -5.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4083 -4.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7042 -4.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8542 -5.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8542 -6.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7042 -6.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0083 -6.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1542 -6.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1083 -6.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3042 -6.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 1 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 2 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 4 13 2 0 0 0 0 12 14 1 0 0 0 0 M END > CFN90567 > 7-Ethoxycoumarin > 31005-02-4 > 98% > C11H10O3 > 190.2 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/7-Ethoxycoumarin-CFN90567.html $$$$ -ISIS- 10201511232D 23 25 0 0 0 0 0 0 0 0999 V2000 7.3667 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3667 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3875 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7625 -6.5917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9542 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -6.5917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1500 -7.5208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9542 -7.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7625 -7.5208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5625 -7.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9542 -8.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -7.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -6.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 13 12 1 1 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 13 1 0 0 0 0 18 19 1 6 0 0 0 17 20 1 1 0 0 0 16 21 1 6 0 0 0 15 22 1 1 0 0 0 22 23 1 0 0 0 0 M END > CFN97505 > Skimmin > 93-39-0 > 98% > C15H16O8 > 324.3 > Powder > Coumarins > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Skimmin-CFN97505.html $$$$ -ISIS- 10201511232D 32 35 0 0 0 0 0 0 0 0999 V2000 7.3667 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3667 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3875 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7625 -6.5917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9542 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -6.5917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1500 -7.5208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9542 -7.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7625 -7.5208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5625 -7.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9542 -8.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -7.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -6.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7458 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6458 -5.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7375 -5.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -5.8125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8958 -6.5042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7042 -7.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3833 -6.4708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5292 -5.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5292 -4.4208 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 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 13 12 1 1 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 13 1 0 0 0 0 18 19 1 6 0 0 0 17 20 1 1 0 0 0 16 21 1 6 0 0 0 15 22 1 1 0 0 0 22 23 1 0 0 0 0 24 23 1 1 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 24 1 0 0 0 0 28 29 1 6 0 0 0 27 30 1 6 0 0 0 27 31 1 0 0 0 0 31 32 1 0 0 0 0 M END > CFN90311 > Apiosylskimmin > 103529-94-8 > 98% > C20H24O12 > 456.40 > Powder > Coumarins > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Apiosylskimmin-CFN90311.html $$$$ -ISIS- 10201511232D 22 23 0 0 0 0 0 0 0 0999 V2000 8.5667 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5667 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -11.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9083 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6917 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6917 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9083 -11.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4708 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7833 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0042 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2208 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8792 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3167 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5375 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3167 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 13 12 1 0 0 0 0 14 13 1 0 0 0 0 15 14 2 0 0 0 0 16 15 1 0 0 0 0 17 16 1 0 0 0 0 18 17 1 0 0 0 0 19 18 2 0 0 0 0 15 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 M END > CFN98787 > Auraptene > 495-02-3 > 98% > C19H22O3 > 298.4 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Auraptene-CFN98787.html $$$$ -ISIS- 10201511232D 24 25 0 0 0 0 0 0 0 0999 V2000 8.5667 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5667 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -11.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9083 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6917 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6917 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9083 -11.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4708 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7833 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0042 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2208 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8792 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -13.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3167 -12.9833 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4417 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5375 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3167 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5375 -12.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -14.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 13 12 1 0 0 0 0 14 13 1 0 0 0 0 15 14 2 0 0 0 0 16 15 1 0 0 0 0 17 16 1 0 0 0 0 18 17 1 0 0 0 0 19 18 1 0 0 0 0 15 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 19 23 1 0 0 0 0 18 24 1 1 0 0 0 M END > CFN99621 > Marmin > 14957-38-1 > 98% > C19H24O5 > 332.4 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Marmin-CFN99621.html $$$$ -ISIS- 10201511232D 27 29 0 0 0 0 0 0 0 0999 V2000 8.5667 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5667 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -11.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9083 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6917 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6917 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9083 -11.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4708 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7833 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0042 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2208 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8792 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -13.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3167 -12.9833 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4417 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6458 -13.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0125 -14.4083 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9125 -14.3167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -12.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7667 -12.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2333 -14.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0125 -15.3125 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 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 13 12 1 0 0 0 0 14 13 1 0 0 0 0 15 14 2 0 0 0 0 16 15 1 0 0 0 0 17 16 1 0 0 0 0 18 17 1 0 0 0 0 19 18 1 0 0 0 0 15 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 18 23 1 1 0 0 0 19 24 1 0 0 0 0 19 25 1 0 0 0 0 22 26 1 0 0 0 0 22 27 1 0 0 0 0 M END > CFN98408 > Marmin acetonide > 320624-68-8 > 98% > C22H28O5 > 372.5 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Marmin-acetonide-CFN98408.html $$$$ -ISIS- 10201511232D 26 27 0 0 0 0 0 0 0 0999 V2000 8.5667 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5667 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -11.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9083 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6917 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6917 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9083 -11.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4708 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7833 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0042 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2208 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8792 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -13.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3167 -12.9833 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4417 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5375 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3167 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5375 -12.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -14.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7542 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -12.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 13 12 1 0 0 0 0 14 13 1 0 0 0 0 15 14 2 0 0 0 0 16 15 1 0 0 0 0 17 16 1 0 0 0 0 18 17 1 0 0 0 0 19 18 1 0 0 0 0 15 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 19 23 1 0 0 0 0 18 24 1 1 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 M END > CFN97584 > 7'-O-Ethylmarmin > N/A > 98% > C21H28O5 > 360.5 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/7-O-Ethylmarmin-CFN97584.html $$$$ -ISIS- 10201511232D 26 29 0 0 0 0 0 0 0 0999 V2000 8.6667 -11.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -12.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4417 -12.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2167 -12.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2167 -11.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4417 -10.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9875 -12.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7625 -12.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7625 -11.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9875 -10.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5375 -12.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -12.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1167 -12.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3458 -12.5208 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5708 -12.0750 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7958 -12.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -12.0750 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2458 -12.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4708 -12.0750 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7000 -12.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5708 -11.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5708 -12.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -11.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4708 -11.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -10.7333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4708 -12.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 13 12 1 0 0 0 0 14 13 1 0 0 0 0 15 14 1 0 0 0 0 16 15 1 0 0 0 0 17 16 1 0 0 0 0 18 17 1 0 0 0 0 19 18 1 0 0 0 0 20 19 1 0 0 0 0 15 21 1 0 0 0 0 15 22 1 0 0 0 0 14 22 1 0 0 0 0 17 23 1 0 0 0 0 19 24 1 0 0 0 0 24 23 1 0 0 0 0 24 25 2 0 0 0 0 19 26 1 0 0 0 0 M END > CFN98274 > Excavatin M > 250293-31-3 > 98% > C19H20O7 > 360.4 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Excavatin-M-CFN98274.html $$$$ -ISIS- 10201511232D 13 14 0 0 0 0 0 0 0 0999 V2000 4.9917 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -7.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -8.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 3 13 1 0 0 0 0 M END > CFN99952 > Daphnetin > 486-35-1 > 98% > C9H6O4 > 178.14 > White cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Daphnetin-CFN99952.html $$$$ -ISIS- 10201511232D 14 15 0 0 0 0 0 0 0 0999 V2000 4.9250 -6.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7083 -7.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 -6.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7083 -5.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2708 -7.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0542 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0542 -6.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2708 -5.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8417 -7.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7083 -8.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -7.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3583 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 3 1 0 0 0 0 2 13 1 0 0 0 0 13 14 1 0 0 0 0 M END > CFN90593 > Daphnetin 7-methyl ether > 19492-03-6 > 98% > C10H8O4 > 192.17 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Daphnetin-7-methyl-ether-CFN90593.html $$$$ -ISIS- 10201511232D 15 16 0 0 0 0 0 0 0 0999 V2000 4.9250 -6.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7083 -7.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 -6.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7083 -5.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2708 -7.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0542 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0542 -6.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2708 -5.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8417 -7.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7083 -8.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -7.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3583 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -9.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 3 1 0 0 0 0 2 13 1 0 0 0 0 13 14 1 0 0 0 0 12 15 1 0 0 0 0 M END > CFN90594 > Daphnetin dimethyl ether > 2445-80-9 > 98% > C11H10O4 > 206.19 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Daphnetin-dimethyl-ether-CFN90594.html $$$$ -ISIS- 10201511232D 13 14 0 0 0 0 0 0 0 0999 V2000 4.9917 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -7.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -5.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 M END > CFN99115 > 6,7-Dihydroxycoumarin > 305-01-1 > 98% > C9H6O4 > 178.14 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/6-7-Dihydroxycoumarin-CFN99115.html $$$$ -ISIS- 10201511232D 24 26 0 0 0 0 0 0 0 0999 V2000 7.5833 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5833 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -6.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5750 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -4.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -3.5250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5833 -3.0667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5833 -2.1417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7833 -1.6833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9875 -2.1417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9875 -3.0667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3792 -1.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1875 -1.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -0.7625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1875 -3.5250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -0.7625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 1 13 1 0 0 0 0 14 13 1 1 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 14 1 0 0 0 0 16 20 1 1 0 0 0 18 21 1 1 0 0 0 17 22 1 6 0 0 0 19 23 1 6 0 0 0 20 24 1 0 0 0 0 M END > CFN99114 > Esculin > 531-75-9 > 98% > C15H16O9 > 340.28 > White powder > Coumarins > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Esculin-CFN99114.html $$$$ -ISIS- 10201511232D 14 15 0 0 0 0 0 0 0 0999 V2000 4.9917 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -7.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -5.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3625 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 12 14 1 0 0 0 0 M END > CFN97684 > Isoscopoletin > 776-86-3 > 98% > C10H8O4 > 192.17 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Isoscopoletin-CFN97684.html $$$$ -ISIS- 10201511232D 14 15 0 0 0 0 0 0 0 0999 V2000 4.9917 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -7.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -5.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3583 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 M END > CFN97494 > Scopoletin > 92-61-5 > 98% > C10H8O4 > 192.2 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Scopoletin-CFN97494.html $$$$ -ISIS- 10201511232D 17 18 0 0 0 0 0 0 0 0999 V2000 4.9917 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -7.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -5.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3583 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1792 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3625 -8.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9958 -8.6583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 M END > CFN98951 > Scopoletin acetate > 56795-51-8 > 98% > C12H10O5 > 234.2 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Scopoletin-acetate-CFN98951.html $$$$ -ISIS- 10201511232D 19 20 0 0 0 0 0 0 0 0999 V2000 8.6667 -11.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -12.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4417 -12.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2167 -12.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2167 -11.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4417 -10.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9875 -12.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7625 -12.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7625 -11.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9875 -10.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5375 -12.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -12.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1167 -12.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3458 -12.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5708 -12.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7958 -12.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5708 -11.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -10.7333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -9.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 13 12 1 0 0 0 0 14 13 1 0 0 0 0 15 14 2 0 0 0 0 16 15 1 0 0 0 0 15 17 1 0 0 0 0 1 18 1 0 0 0 0 18 19 1 0 0 0 0 M END > CFN92639 > 7-O-Prenylscopoletin > 13544-37-1 > 98% > C15H16O4 > 260.3 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/7-O-Prenylscopoletin-CFN92639.html $$$$ -ISIS- 10201511232D 24 25 0 0 0 0 0 0 0 0999 V2000 8.5667 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5667 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -11.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9083 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6917 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6917 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9083 -11.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4708 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7833 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0042 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2208 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8792 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3167 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5375 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3167 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7875 -11.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0083 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 13 12 1 0 0 0 0 14 13 1 0 0 0 0 15 14 2 0 0 0 0 16 15 1 0 0 0 0 17 16 1 0 0 0 0 18 17 1 0 0 0 0 19 18 2 0 0 0 0 15 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 1 23 1 0 0 0 0 23 24 1 0 0 0 0 M END > CFN98348 > 7-Geranyloxy-6-methoxycoumarin > 28587-43-1 > 98% > C20H24O4 > 328.4 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/7-Geranyloxy-6-methoxycoumarin-CFN98348.html $$$$ -ISIS- 10201511232D 25 27 0 0 0 0 0 0 0 0999 V2000 7.5833 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5833 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -6.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5750 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -4.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -6.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1875 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3917 -6.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3917 -7.6708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1875 -8.1333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9875 -7.6708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1875 -9.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5917 -6.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -8.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5917 -8.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7958 -6.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 15 1 0 0 0 0 15 12 1 1 0 0 0 19 21 1 1 0 0 0 17 22 1 1 0 0 0 20 23 1 6 0 0 0 18 24 1 6 0 0 0 22 25 1 0 0 0 0 M END > CFN98887 > Scopolin > 531-44-2 > 98% > C16H18O9 > 354.3 > Powder > Coumarins > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Scopolin-CFN98887.html $$$$ -ISIS- 10201511232D 15 16 0 0 0 0 0 0 0 0999 V2000 4.9917 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -7.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -5.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3625 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3583 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 12 14 1 0 0 0 0 13 15 1 0 0 0 0 M END > CFN99314 > Scoparone > 120-08-1 > 98% > C11H10O4 > 206.2 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Scoparone-CFN99314.html $$$$ -ISIS- 10201511232D 15 16 0 0 0 0 0 0 0 0999 V2000 7.5833 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5833 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -6.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5750 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -4.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 3 15 1 0 0 0 0 M END > CFN99113 > Fraxetin > 574-84-5 > 98% > C10H8O5 > 208.17 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Fraxetin-CFN99113.html $$$$ -ISIS- 10201511232D 26 28 0 0 0 0 0 0 0 0999 V2000 7.5833 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5833 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -6.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5750 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -4.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5833 -7.6708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7833 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -7.6708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9875 -8.5917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7833 -9.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5833 -8.5917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1875 -7.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -9.9750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1875 -9.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -9.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3917 -7.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 3 15 1 0 0 0 0 16 15 1 1 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 16 1 0 0 0 0 18 22 1 1 0 0 0 20 23 1 1 0 0 0 19 24 1 6 0 0 0 21 25 1 6 0 0 0 22 26 1 0 0 0 0 M END > CFN99747 > Fraxin > 524-30-1 > 98% > C16H18O10 > 370.32 > White powder > Coumarins > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Fraxin-CFN99747.html $$$$ -ISIS- 10201511232D 16 17 0 0 0 0 0 0 0 0999 V2000 7.5833 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5833 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -6.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5750 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -4.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5833 -7.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 3 15 1 0 0 0 0 15 16 1 0 0 0 0 M END > CFN90181 > Isofraxidin > 486-21-5 > 98% > C11H10O5 > 222.19 > White powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Isofraxidin-CFN90181.html $$$$ -ISIS- 10201511232D 27 29 0 0 0 0 0 0 0 0999 V2000 7.5875 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5875 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3833 -6.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1833 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1833 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3833 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9833 -6.2917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9833 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5792 -6.2917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7875 -6.2917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7875 -4.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -6.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1917 -6.2917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3917 -6.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3917 -7.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1917 -8.1333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9875 -7.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1917 -9.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5917 -6.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7875 -8.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5917 -8.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7958 -6.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3833 -7.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1833 -7.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 15 1 0 0 0 0 15 12 1 1 0 0 0 19 21 1 1 0 0 0 17 22 1 1 0 0 0 20 23 1 6 0 0 0 18 24 1 6 0 0 0 22 25 1 0 0 0 0 3 26 1 0 0 0 0 26 27 1 0 0 0 0 M END > CFN98764 > Calycanthoside > 483-91-0 > 98% > C17H20O10 > 384.3 > Powder > Coumarins > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Calycanthoside-CFN98764.html $$$$ -ISIS- 10201511232D 16 17 0 0 0 0 0 0 0 0999 V2000 7.5833 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5833 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -6.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5750 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -4.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 3 15 1 0 0 0 0 12 16 1 0 0 0 0 M END > CFN98860 > Fraxidin > 525-21-3 > 98% > C11H10O5 > 222.2 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Fraxidin-CFN98860.html $$$$ -ISIS- 10201511232D 17 18 0 0 0 0 0 0 0 0999 V2000 7.5833 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5833 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -6.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5750 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -6.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -4.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -4.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5833 -7.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 3 15 1 0 0 0 0 12 16 1 0 0 0 0 15 17 1 0 0 0 0 M END > CFN97024 > 6,7,8-Trimethoxycoumarin > 6035-49-0 > 98% > C12H12O5 > 236.2 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/6-7-8-Trimethoxycoumarin-CFN97024.html $$$$ -ISIS- 10201511232D 17 18 0 0 0 0 0 0 0 0999 V2000 4.9917 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -7.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3583 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -4.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -3.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -8.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 12 13 1 0 0 0 0 6 14 1 0 0 0 0 14 15 1 0 0 0 0 3 16 1 0 0 0 0 16 17 1 0 0 0 0 M END > CFN92670 > Murrayacarpin B > 120693-44-9 > 98% > C12H12O5 > 236.2 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Murrayacarpin-B-CFN92670.html $$$$ -ISIS- 10201511232D 17 18 0 0 0 0 0 0 0 0999 V2000 7.3667 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3667 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3875 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7625 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -3.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3708 -2.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -7.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3750 -7.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 12 13 1 0 0 0 0 6 14 1 0 0 0 0 14 15 1 0 0 0 0 3 16 1 0 0 0 0 16 17 1 0 0 0 0 M END > CFN97036 > 5,7,8-Trimethoxycoumarin > 60796-65-8 > 98% > C12H12O5 > 236.2 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/5-7-8-Trimethoxycoumarin-CFN97036.html $$$$ -ISIS- 10201511232D 21 22 0 0 0 0 0 0 0 0999 V2000 7.4833 -11.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4833 -12.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2625 -12.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0375 -12.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0375 -11.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2625 -10.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8125 -12.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -12.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -11.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8125 -10.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3625 -12.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2625 -10.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4833 -9.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2625 -13.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7083 -12.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -12.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4833 -14.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7083 -13.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -14.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1583 -13.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -14.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 6 12 1 0 0 0 0 12 13 1 0 0 0 0 3 14 1 0 0 0 0 2 15 1 0 0 0 0 16 15 1 0 0 0 0 17 14 1 0 0 0 0 18 17 1 0 0 0 0 19 18 2 0 0 0 0 20 19 1 0 0 0 0 19 21 1 0 0 0 0 M END > CFN97547 > Artanin > 96917-26-9 > 98% > C16H18O5 > 290.3 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Artanin-CFN97547.html $$$$ -ISIS- 10201511232D 26 27 0 0 0 0 0 0 0 0999 V2000 7.4833 -11.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4833 -12.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2625 -12.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0375 -12.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0375 -11.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2625 -10.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8125 -12.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -12.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -11.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8125 -10.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3625 -12.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2625 -10.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4833 -9.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2625 -13.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7083 -12.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -12.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4833 -14.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7083 -13.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -14.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1583 -13.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3833 -14.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6083 -13.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8292 -14.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0542 -13.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -14.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8292 -14.9875 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 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 6 12 1 0 0 0 0 12 13 1 0 0 0 0 3 14 1 0 0 0 0 2 15 1 0 0 0 0 16 15 1 0 0 0 0 17 14 1 0 0 0 0 18 17 1 0 0 0 0 19 18 2 0 0 0 0 20 19 1 0 0 0 0 21 20 1 0 0 0 0 22 21 1 0 0 0 0 23 22 2 0 0 0 0 24 23 1 0 0 0 0 19 25 1 0 0 0 0 23 26 1 0 0 0 0 M END > CFN99344 > 8-Geranyloxy-5,7-dimethoxycoumarin > 1228175-65-2 > 98% > C21H26O5 > 358.4 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/8-Geranyloxy-5-7-dimethoxycoumarin-CFN99344.html $$$$ -ISIS- 10201511232D 16 17 0 0 0 0 0 0 0 0999 V2000 4.9458 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -7.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -7.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5333 -7.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5333 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -6.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -7.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1250 -7.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1250 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -6.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9167 -7.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -5.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1542 -6.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3583 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -8.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9500 -9.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 6 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 3 15 1 0 0 0 0 15 16 1 0 0 0 0 M END > CFN92736 > Arteminin > 466639-11-2 > 98% > C11H10O5 > 222.2 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Arteminin-CFN92736.html $$$$ -ISIS- 10201511232D 16 17 0 0 0 0 0 0 0 0999 V2000 7.3667 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3667 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3875 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7625 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -3.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3708 -2.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -4.2708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 12 13 1 0 0 0 0 6 14 1 0 0 0 0 14 15 1 0 0 0 0 1 16 1 0 0 0 0 M END > CFN98768 > Fraxinol > 486-28-2 > 98% > C11H10O5 > 222.2 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Fraxinol-CFN98768.html $$$$ -ISIS- 10201511232D 16 17 0 0 0 0 0 0 0 0999 V2000 7.3667 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3667 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3875 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7625 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -3.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -4.2708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7583 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 12 13 1 0 0 0 0 6 14 1 0 0 0 0 1 15 1 0 0 0 0 15 16 1 0 0 0 0 M END > CFN98347 > Tomentin > 28449-62-9 > 98% > C11H10O5 > 222.2 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Tomentin-CFN98347.html $$$$ -ISIS- 10201511232D 19 20 0 0 0 0 0 0 0 0999 V2000 7.3667 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3667 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3875 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7625 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -3.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3708 -2.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -7.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3750 -7.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -4.2708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7583 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 12 13 1 0 0 0 0 6 14 1 0 0 0 0 14 15 1 0 0 0 0 3 16 1 0 0 0 0 16 17 1 0 0 0 0 1 18 1 0 0 0 0 18 19 1 0 0 0 0 M END > CFN98941 > 5,6,7,8-Tetramethoxycoumarin > 56317-15-8 > 98% > C13H14O6 > 266.3 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/5-6-7-8-Tetramethoxycoumarin-CFN98941.html $$$$ -ISIS- 10201511232D 14 15 0 0 0 0 0 0 0 0999 V2000 4.6750 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -7.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3375 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3375 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1667 -7.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9958 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9958 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1667 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8250 -7.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8458 -7.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -4.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -3.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 6 13 1 0 0 0 0 13 14 1 0 0 0 0 M END > CFN92630 > 5-Methoxy-7-hydroxycoumarin > 3067-10-5 > 98% > C10H8O4 > 192.2 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/5-Methoxy-7-hydroxycoumarin-CFN92630.html $$$$ -ISIS- 10201511232D 15 16 0 0 0 0 0 0 0 0999 V2000 4.9458 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -7.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -7.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5333 -7.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5333 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -6.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -7.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1250 -7.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1250 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -6.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9167 -7.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -5.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -4.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -7.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3542 -7.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 6 12 1 0 0 0 0 12 13 1 0 0 0 0 2 14 1 0 0 0 0 14 15 1 0 0 0 0 M END > CFN97963 > Citropten > 487-06-9 > 98% > C11H10O4 > 206.2 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Citropten-CFN97963.html $$$$ -ISIS- 10201511232D 24 25 0 0 0 0 0 0 0 0999 V2000 8.5667 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5667 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -11.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9083 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6917 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6917 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9083 -11.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4708 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -10.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 -10.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7833 -13.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0042 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2208 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8792 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3167 -12.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5375 -13.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3167 -12.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 6 12 1 0 0 0 0 12 13 1 0 0 0 0 14 2 1 0 0 0 0 15 14 1 0 0 0 0 16 15 1 0 0 0 0 17 16 2 0 0 0 0 18 17 1 0 0 0 0 19 18 1 0 0 0 0 20 19 1 0 0 0 0 21 20 2 0 0 0 0 17 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 M END > CFN99003 > 7-Geranyloxy-5-methoxycoumarin > 1432075-68-7 > 98% > C20H24O4 > 328.4 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/7-Geranyloxy-5-methoxycoumarin-CFN99003.html $$$$ -ISIS- 10201511232D 15 16 0 0 0 0 0 0 0 0999 V2000 4.9917 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -7.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3542 -5.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3583 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 12 15 1 0 0 0 0 M END > CFN92666 > 6-Hydroxymethylherniarin > 117597-79-2 > 98% > C11H10O4 > 206.2 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/6-Hydroxymethylherniarin-CFN92666.html $$$$ -ISIS- 10201511232D 15 16 0 0 0 0 0 0 0 0999 V2000 4.9917 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -7.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3542 -5.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -4.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 M END > CFN97325 > 7-Hydroxycoumarin-6-carboxylic acid > 833-52-3 > 98% > C10H6O5 > 206.2 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/7-Hydroxycoumarin-6-carboxylic-acid-CFN97325.html $$$$ -ISIS- 10201511232D 18 19 0 0 0 0 0 0 0 0999 V2000 7.3667 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3667 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -4.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3875 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7625 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -3.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3708 -2.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -4.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7625 -4.7333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -3.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 12 13 1 0 0 0 0 6 14 1 0 0 0 0 14 15 1 0 0 0 0 1 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 M END > CFN92511 > 6-Formyllimetin > 88140-31-2 > 98% > C12H10O5 > 234.2 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/6-Formyllimetin-CFN92511.html $$$$ -ISIS- 10201511232D 13 14 0 0 0 0 0 0 0 0999 V2000 4.9458 -6.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -7.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5375 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5375 -6.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 -7.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -6.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9250 -7.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 -5.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1542 -7.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 10 12 1 0 0 0 0 2 13 1 0 0 0 0 M END > CFN90421 > 4-Methylumbelliferone > 90-33-5 > 98% > C10H8O3 > 176.17 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/4-Methylumbelliferone-CFN90421.html $$$$ -ISIS- 10201511232D 15 16 0 0 0 0 0 0 0 0999 V2000 4.9458 -6.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -7.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5375 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5375 -6.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 -7.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -6.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9250 -7.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 -5.1917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -4.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -6.1083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3542 -6.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 1 14 1 0 0 0 0 14 15 1 0 0 0 0 M END > CFN92538 > 4,6-Dimethoxy-2H-1-benzopyran-2-one > 53666-78-7 > 98% > C11H10O4 > 206.2 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/4-6-Dimethoxy-2H-1-benzopyran-2-one-CFN92538.html $$$$ -ISIS- 10201511232D 18 19 0 0 0 0 0 0 0 0999 V2000 4.9458 -6.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -7.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5375 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5375 -6.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 -7.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -6.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9250 -7.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -5.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -7.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3542 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 -5.1917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -4.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -6.1083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3542 -6.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 6 12 1 0 0 0 0 2 13 1 0 0 0 0 13 14 1 0 0 0 0 10 15 1 0 0 0 0 15 16 1 0 0 0 0 1 17 1 0 0 0 0 17 18 1 0 0 0 0 M END > CFN97084 > 4,6,7-Trimethoxy-5-methylcoumarin > 62615-63-8 > 98% > C13H14O5 > 250.3 > Yellow powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/4-6-7-Trimethoxy-5-methylcoumarin-CFN97084.html $$$$ -ISIS- 10201511232D 26 29 0 0 0 0 0 0 0 0999 V2000 3.6250 -4.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8375 -5.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8375 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 -6.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4125 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4125 -5.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2000 -6.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -5.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2000 -4.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7750 -6.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0542 -6.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0542 -7.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2667 -7.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4792 -7.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4792 -8.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2667 -8.9750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0542 -8.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8375 -8.9750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3083 -7.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0958 -7.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0958 -8.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3083 -8.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8833 -7.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8833 -8.9750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6708 -7.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 6 1 0 0 0 0 8 11 2 0 0 0 0 3 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 13 1 0 0 0 0 18 19 2 0 0 0 0 15 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 16 1 0 0 0 0 21 24 1 0 0 0 0 22 25 1 0 0 0 0 24 26 1 0 0 0 0 M END > CFN90329 > Daphnoretin > 2034-69-7 > 98% > C19H12O7 > 352.3 > White powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Daphnoretin-CFN90329.html $$$$ -ISIS- 10201511232D 13 14 0 0 0 0 0 0 0 0999 V2000 6.3375 -5.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1583 -6.2958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9458 -5.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1875 -7.2250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -5.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9417 -6.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9667 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7875 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5792 -7.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -7.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4292 -8.6375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8167 -8.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 1 0 0 0 2 4 1 0 0 0 0 1 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 4 11 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 9 13 1 0 0 0 0 M END > CFN97913 > Mellein > 480-33-1 > 98% > C10H10O3 > 178.2 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Mellein-CFN97913.html $$$$ -ISIS- 10201511232D 30 33 0 0 0 0 0 0 0 0999 V2000 5.5500 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -5.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9417 -6.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9667 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7875 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5792 -7.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4042 -7.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1917 -7.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1583 -6.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3375 -5.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0125 -7.6583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6958 -4.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8792 -4.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -7.8167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3708 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -10.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -10.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7833 -11.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5875 -10.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5875 -10.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7833 -9.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3917 -11.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2000 -10.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2000 -10.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3917 -9.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3917 -8.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3917 -12.3917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0042 -9.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8083 -10.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1708 -11.4625 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 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 1 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 12 13 1 0 0 0 0 4 14 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 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 20 21 2 0 0 0 0 21 16 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 20 1 0 0 0 0 25 26 2 0 0 0 0 22 27 2 0 0 0 0 24 28 1 0 0 0 0 28 29 1 0 0 0 0 17 30 1 0 0 0 0 5 21 1 0 0 0 0 M END > CFN92734 > Toddacoumaquinone > 142878-03-3 > 98% > C23H18O7 > 406.4 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Toddacoumaquinone-CFN92734.html $$$$