Mol:FLIFHXNS0003

<pre>

Copyright: ARM project http://www.metabolome.jp/
 27 30  0  0  0  0  0  0  0  0999 V2000
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   -2.2825    0.1649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7262   -0.1563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1699    0.1649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1699    0.8072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7262    1.1284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6136   -0.1563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0573    0.1649    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.0573    0.8072    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.6136    1.1284    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4988   -0.1562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4988   -0.8430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.6883   -0.8430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6883   -0.1562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0936    0.1872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4988    1.1283    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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    1.1000    0.8072    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4987    1.7704    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6762   -1.3579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3907   -1.7704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6883   -0.8430    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6883   -0.8430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6398    1.4260    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1398    2.2920    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  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  9 17  1  0  0  0  0
  7 18  2  0  0  0  0
  3 19  1  0  0  0  0
 16 20  1  0  0  0  0
 20 17  1  0  0  0  0
 17 21  1  0  0  0  0
 13 22  1  0  0  0  0
 22 23  1  0  0  0  0
 14 24  1  0  0  0  0
 24 25  1  0  0  0  0
  1 26  1  0  0  0  0
 26 27  1  0  0  0  0
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  26  27
M  SBL   3  1  29
M  SMT   3  OCH3
M  SVB   3 29   -2.6398     1.426
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  24  25
M  SBL   2  1  27
M  SMT   2  OCH3
M  SVB   2 27    1.9253   -1.0492
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  22  23
M  SBL   1  1  25
M  SMT   1  OCH3
M  SVB   1 25    0.6762   -1.3579
S  SKP  8
ID	FLIFHXNS0003
KNApSAcK_ID	C00009975
NAME	Dihydrostemonal;6,11-Dihydroxy-2,3,9-trimethoxyrotenone
CAS_RN	125164-60-5
FORMULA	C19H18O8
EXACTMASS	374.100167552
AVERAGEMASS	374.34142
SMILES	c(c4OC)(OC)cc(c(c4)1)OC(C(O2)C(C(c(c(O)3)c2cc(OC)c3)=O)1)O
M  END

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