
 OpenBabel04291915413D

 51 55  0  0  1  0  0  0  0  0999 V2000
   -9.4960   19.3027    1.4478 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9760   19.3027    1.4478 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3244   19.2490    2.7778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1303   18.7150    2.9033 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4953   18.6627    4.1991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2750   18.1169    4.3274 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1869   20.0377    0.5756 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6845   18.0683    5.5325 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4642   17.5225    5.6608 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8737   17.4739    6.8659 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0247   18.7226    4.1895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9981   17.8668    4.3929 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7446   16.5171    4.5876 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.6690   15.9977    4.7316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0318   15.9544    3.3687 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8330   16.1174    2.2484 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4029   15.6894    1.0435 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1787   15.8473   -0.0412 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7506   15.4212   -1.2407 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4533   14.8373   -1.3553 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8815   14.4113   -2.5548 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4042   14.8963    6.0235 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1334   16.3384    5.8154 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.0578   16.8578    5.6715 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5616   16.8870    7.0038 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6736   15.9177    7.8510 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2517   14.6749   -0.2390 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4519   15.5381    0.4952 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5489   15.5837   -2.3570 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7386   14.9329   -2.6484 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9995   17.9676    0.7216 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8527   20.1889    1.9299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8527   18.4421    1.9743 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8527   19.2770    0.4394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8083   19.6310    3.6054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6463   18.3329    2.0757 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1685   18.4503    6.3601 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9803   17.1405    4.8332 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1637   14.9132    3.5190 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8926   16.4737    3.2248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1039   16.2960    0.0469 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0782   14.2148   -3.5486 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8416   15.6281    1.4877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5451   15.1519    0.5371 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4423   16.5003    0.0272 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1138   15.2796   -3.5886 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4550   15.1387   -1.8807 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5648   13.8784   -2.7007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9964   17.6406    0.5438 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5094   18.0786   -0.2125 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5094   17.2437    1.3224 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 32  1  0  0  0  0
  1 33  1  0  0  0  0
  1 34  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  1  0  0  0  0
  2 31  1  0  0  0  0
  3  4  2  0  0  0  0
  3 35  1  0  0  0  0
  4  5  1  0  0  0  0
  4 36  1  0  0  0  0
  5  6  2  0  0  0  0
  5 11  1  0  0  0  0
  6  8  1  0  0  0  0
  6  7  1  0  0  0  0
  8  9  2  0  0  0  0
  8 37  1  0  0  0  0
  9 10  1  0  0  0  0
  9 38  1  0  0  0  0
 10 25  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 23  1  0  0  0  0
 13 15  1  0  0  0  0
 13 14  1  6  0  0  0
 15 16  1  0  0  0  0
 15 39  1  0  0  0  0
 15 40  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 22  1  0  0  0  0
 18 19  1  0  0  0  0
 18 41  1  0  0  0  0
 19 20  2  0  0  0  0
 19 29  1  0  0  0  0
 20 21  1  0  0  0  0
 20 27  1  0  0  0  0
 21 22  2  0  0  0  0
 21 42  1  0  0  0  0
 22 23  1  0  0  0  0
 23 25  1  0  0  0  0
 23 24  1  6  0  0  0
 25 26  2  0  0  0  0
 27 28  1  0  0  0  0
 28 43  1  0  0  0  0
 28 44  1  0  0  0  0
 28 45  1  0  0  0  0
 29 30  1  0  0  0  0
 30 46  1  0  0  0  0
 30 47  1  0  0  0  0
 30 48  1  0  0  0  0
 31 49  1  0  0  0  0
 31 50  1  0  0  0  0
 31 51  1  0  0  0  0
M  END
>  <SKU>
A13460

>  <Product Name>
Deguelin

>  <CAS>
522-17-8

>  <M.Wt>
394.41718

>  <Formula>
C23H22O6

>  <Synonyms>
N/A

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

$$$$
