-ISIS-  05031710462D

 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
>  <Catalog No.>
CFN99163

>  <Name>
Sodium Danshensu

>  <CAS Number>
67920-52-9

>  <Purity>
98%

>  <Formula>
C9H9O5Na

>  <Mol Weight>
220.2

>  <Physical Description>
Powder

>  <Type of Compound>
Phenylpropanoids

>  <Solvent>
Pyridine, Methanol, Ethanol, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Sodium-Danshensu-CFN99163.html

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