
 OpenBabel04291915343D

 29 31  0  0  0  0  0  0  0  0999 V2000
    0.9613   -0.0340    0.0857 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4433   -0.0340    0.0857 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1148   -0.4632    1.1666 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4577   -0.4632    1.1666 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1292   -0.0340    0.0857 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4577    0.3951   -0.9952 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1148    0.3951   -0.9952 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1797    0.8566   -2.1575 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4073    0.8566   -2.1575 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4577    1.3181   -3.3198 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1292    1.7473   -4.4007 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5732   -0.0340    0.0857 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1870   -0.4263    1.0738 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4577    2.1764   -5.4816 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1148    2.1764   -5.4816 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4433    1.7473   -4.4007 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1148    1.3181   -3.3198 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1322    2.6075   -6.5674 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1322   -0.8943    2.2525 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6047   -0.4063    1.0233 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6047   -0.6599   -0.7055 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6047    0.9641   -0.0607 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5988   -0.7930    1.9973 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5988    0.7249   -1.8259 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5988    2.5062   -6.3123 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4113    1.7473   -4.4007 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5988    0.9883   -2.4891 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0692    2.6075   -6.5674 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6637   -1.1938    3.0066 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 20  1  0  0  0  0
  1 21  1  0  0  0  0
  1 22  1  0  0  0  0
  2  3  2  0  0  0  0
  2  7  1  0  0  0  0
  3  4  1  0  0  0  0
  3 23  1  0  0  0  0
  4 19  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  5 12  1  0  0  0  0
  6  8  1  0  0  0  0
  6  7  2  0  0  0  0
  7 24  1  0  0  0  0
  8 10  1  0  0  0  0
  8  9  2  0  0  0  0
 10 11  2  0  0  0  0
 10 17  1  0  0  0  0
 11 14  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 14 18  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 15 25  1  0  0  0  0
 16 17  2  0  0  0  0
 16 26  1  0  0  0  0
 17 27  1  0  0  0  0
 18 28  1  0  0  0  0
 19 29  1  0  0  0  0
M  END
>  <SKU>
A10210

>  <Product Name>
Chrysophanic acid (Chrysophanol)

>  <CAS>
481-74-3

>  <M.Wt>
254.2375

>  <Formula>
C15H10O4

>  <Synonyms>
Chrysophanol, NSC 37132, NSC 646567

>  <URL>
https://www.adooq.com/chrysophanic-acid-chrysophanol.html

$$$$
