Mol:FL1CG9NS0002

<pre>

Copyright: ARM project http://www.metabolome.jp/
 24 25  0  0  0  0  0  0  0  0999 V2000
   -2.8395   -0.3009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2191   -0.4672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7649   -0.0130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9311    0.6075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5516    0.7738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0058    0.3195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4769    1.0617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6432    1.6822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1891    2.1363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3553    2.7565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8973    3.2146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0649    3.8403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6907    4.0079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1486    3.5499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9811    2.9242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9927    0.9320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2936   -0.7550    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1447   -0.1791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6039   -1.0760    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9281   -0.6027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4873    0.7365    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2433    1.3911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8103    1.7397    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0691    2.7056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 10  1  0  0  0  0
  7 16  2  0  0  0  0
  1 17  1  0  0  0  0
  3 18  1  0  0  0  0
  2 19  1  0  0  0  0
 19 20  1  0  0  0  0
  6 21  1  0  0  0  0
 21 22  1  0  0  0  0
  5 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  23  24
M  SBL   3  1  24
M  SMT   3  OCH3
M  SVB   3 24   -0.2038    0.6768
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  21  22
M  SBL   2  1  22
M  SMT   2  OCH3
M  SVB   2 22   -1.0381    1.2499
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  19  20
M  SBL   1  1  20
M  SMT   1  OCH3
M  SVB   1 20   -2.5869   -0.1952
S  SKP  8
ID	FL1CG9NS0002
KNApSAcK_ID	C00006983
NAME	Isodidymocarpin
CAS_RN	71326-08-4
FORMULA	C18H18O6
EXACTMASS	330.110338308
AVERAGEMASS	330.33191999999997
SMILES	C(c(c2O)c(c(c(c2OC)O)OC)OC)(=O)C=Cc(c1)cccc1
M  END

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