
 OpenBabel04291915383D

 30 31  0  0  1  0  0  0  0  0999 V2000
    0.9698    0.0949    0.0091 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3568    0.0949    0.0091 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0313    1.2578    0.1207 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4175    2.3161    0.2223 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4753    1.2578    0.1207 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1323    2.3906    0.2295 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4813    2.3906    0.2295 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1748    3.5863    0.3442 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.2268    3.3916    0.3256 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8076    4.2611    1.6558 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.3426    5.1835    1.7443 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1352    3.2408   -1.5540 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.5765    2.7667   -2.4057 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2119    3.5309   -0.5210 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6006    4.1875    0.6587 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3505    4.5307    1.6817 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7393    5.1873    2.8613 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3430    5.3357    2.6498 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8317    4.4383   -0.7387 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6131   -0.9093   -0.0873 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6131    0.6804   -0.8124 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6131    0.5135    0.9270 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6163    3.2802    0.3149 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6732    2.6137   -0.2195 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9497    4.1781   -0.9470 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5860    4.3752    0.6767 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1829    6.1506    3.0031 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9064    4.5862    3.7306 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1914    5.8806    1.8617 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8781    4.6147   -0.7218 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  1  0  0  0  0
  3  5  1  0  0  0  0
  3  4  2  0  0  0  0
  5  6  2  0  0  0  0
  5 12  1  0  0  0  0
  6  7  1  0  0  0  0
  6 23  1  0  0  0  0
  7  8  1  0  0  0  0
  8 10  1  0  0  0  0
  8  9  1  6  0  0  0
  8 19  1  0  0  0  0
 10 16  1  0  0  0  0
 10 11  1  6  0  0  0
 10 12  1  0  0  0  0
 12 14  1  0  0  0  0
 12 13  1  1  0  0  0
 14 15  1  0  0  0  0
 14 24  1  0  0  0  0
 14 25  1  0  0  0  0
 15 16  2  0  0  0  0
 15 26  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 27  1  0  0  0  0
 17 28  1  0  0  0  0
 18 29  1  0  0  0  0
 19 30  1  0  0  0  0
M  END
>  <SKU>
A11677

>  <Product Name>
Genipin

>  <CAS>
6902-77-8

>  <M.Wt>
226.22586

>  <Formula>
C11H14O5

>  <Synonyms>
N/A

>  <URL>
https://www.adooq.com/genipin.html

$$$$
