-ISIS-  05031710462D

 34 35  0  0  0  0  0  0  0  0999 V2000
    1.1625   -5.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9417   -4.6000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.3833   -4.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7208   -5.0500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.5000   -4.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2792   -5.0500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5000   -3.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1625   -5.9500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9417   -3.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7208   -5.9500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1625   -3.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1625   -2.3542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3833   -3.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3958   -3.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1750   -3.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5000   -6.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5000   -7.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2792   -5.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0583   -6.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8375   -5.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6167   -6.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3958   -5.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3958   -5.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6167   -4.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8375   -5.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9542   -3.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7333   -3.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7333   -4.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9542   -5.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1750   -4.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5125   -5.0500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9542   -5.9500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1708   -4.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6167   -3.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  1  8  2  0  0  0  0
  2  9  1  1  0  0  0
  4 10  1  1  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 10 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 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 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 20  1  0  0  0  0
 15 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 15  1  0  0  0  0
 28 31  1  0  0  0  0
 29 32  1  0  0  0  0
 23 33  1  0  0  0  0
 24 34  1  0  0  0  0
M  END
>  <Catalog No.>
CFN99725

>  <Name>
Chicoric acid

>  <CAS Number>
70831-56-0

>  <Purity>
98%

>  <Formula>
C22H18O12

>  <Mol Weight>
474.37

>  <Physical Description>
White powder

>  <Type of Compound>
Phenylpropanoids

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

>  <WebLink>
http://www.chemfaces.com/natural/Cichoric-Acid-CFN99725.html

$$$$