
 OpenBabel04291915443D

 63 67  0  0  1  0  0  0  0  0999 V2000
    0.9711   26.1282    1.0547 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3140   26.1282    1.0547 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9855   25.0327    1.4451 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3284   25.0327    1.4452 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9998   26.1282    1.0547 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2996   27.2237    0.6642 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0504   23.8548    1.8650 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3644   23.8548    1.8650 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0864   22.6768    2.2849 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4726   21.6754    2.6418 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4354   22.6768    2.2849 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1289   21.5453    2.6882 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6233   21.8069    2.5950 C   0  0  3  0  0  0  0  0  0  0  0  0
   11.3833   20.5670    3.0369 C   0  0  3  0  0  0  0  0  0  0  0  0
   11.0161   19.3995    2.1354 C   0  0  3  0  0  0  0  0  0  0  0  0
   11.7761   18.1596    2.5774 C   0  0  3  0  0  0  0  0  0  0  0  0
   11.4089   16.9921    1.6759 C   0  0  3  0  0  0  0  0  0  0  0  0
   10.9663   22.8976    3.4371 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0128   16.7477    1.7630 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6698   15.6571    0.9209 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.1753   15.3955    1.0141 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.8081   14.2280    0.1126 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.5491   13.0190    0.5435 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8632   13.0190    0.5435 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3632   14.5256    1.3241 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3137   13.9664    0.2059 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.5537   15.2063   -0.2361 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.1868   17.4554    0.1932 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.8968   16.2970    0.6061 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5540   18.6228    1.0947 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8440   19.7812    0.6818 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9707   12.8757   -0.6363 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1722   18.4040    2.4903 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6200   19.1551    2.2225 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7794   20.8114    2.9498 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4551   25.2864    1.3547 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8300   26.9701    0.7547 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4694   24.1909    1.7452 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9494   26.5088    0.9191 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5251   27.8081    0.4559 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5344   23.0129    2.1650 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8804   24.6966    1.5650 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8704   20.7235    2.0536 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8704   21.3101    3.6995 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8818   22.0422    1.5837 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1248   20.3318    4.0482 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.2746   19.6348    1.1241 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.5176   17.9244    3.5887 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.8466   16.1569    1.1702 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9283   15.8923   -0.0905 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2503   15.4471    2.0802 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0667   14.4632   -0.8987 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0331   12.1772    0.8436 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4812   12.2852    0.1633 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0552   13.7312    1.2172 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1451   14.5604   -0.9849 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6060   18.8070    1.0291 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2955   18.3876    2.1060 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0783   19.9944   -0.2350 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2051   13.0890   -1.5531 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.4065   18.6172    1.5735 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3856   18.9419    3.1393 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0137   21.0246    2.0330 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  1 36  1  0  0  0  0
  2  3  1  0  0  0  0
  2 37  1  0  0  0  0
  3  4  2  0  0  0  0
  3 38  1  0  0  0  0
  4  7  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5 39  1  0  0  0  0
  6 40  1  0  0  0  0
  7  8  2  3  0  0  0
  7 41  1  0  0  0  0
  8  9  1  0  0  0  0
  8 42  1  0  0  0  0
  9 11  1  0  0  0  0
  9 10  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 43  1  0  0  0  0
 12 44  1  0  0  0  0
 13 14  1  0  0  0  0
 13 18  1  0  0  0  0
 13 45  1  0  0  0  0
 14 35  1  0  0  0  0
 14 15  1  0  0  0  0
 14 46  1  0  0  0  0
 15 34  1  0  0  0  0
 15 16  1  0  0  0  0
 15 47  1  0  0  0  0
 16 33  1  0  0  0  0
 16 17  1  0  0  0  0
 16 48  1  0  0  0  0
 17 19  1  0  0  0  0
 17 18  1  0  0  0  0
 17 49  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 25  1  0  0  0  0
 20 50  1  0  0  0  0
 21 22  1  0  0  0  0
 21 28  1  0  0  0  0
 21 51  1  0  0  0  0
 22 26  1  0  0  0  0
 22 23  1  0  0  0  0
 22 52  1  0  0  0  0
 23 24  2  0  0  0  0
 23 53  1  0  0  0  0
 24 25  1  0  0  0  0
 24 54  1  0  0  0  0
 26 32  1  0  0  0  0
 26 27  1  0  0  0  0
 26 55  1  0  0  0  0
 27 29  1  0  0  0  0
 27 28  1  0  0  0  0
 27 56  1  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 57  1  0  0  0  0
 30 58  1  0  0  0  0
 31 59  1  0  0  0  0
 32 60  1  0  0  0  0
 33 61  1  0  0  0  0
 34 62  1  0  0  0  0
 35 63  1  0  0  0  0
M  END
>  <SKU>
A14580

>  <Product Name>
Picroside I

>  <CAS>
27409-30-9

>  <M.Wt>
492.47252

>  <Formula>
C24H28O11

>  <Synonyms>
N/A

>  <URL>
https://www.adooq.com/picroside-i.html

$$$$
