Mol:FLIAALNS0006

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 26 28  0  0  0  0  0  0  0  0999 V2000 
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M  STY  1   4 SUP 
M  SLB  1   4   4 
M  SAL   4  2  25  26 
M  SBL   4  1  27 
M  SMT   4  OCH3 
M  SVB   4 27    2.1039    0.2048 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  23  24 
M  SBL   3  1  25 
M  SMT   3  OCH3 
M  SVB   3 25   -2.8184    1.4439 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  21  22 
M  SBL   2  1  23 
M  SMT   2  OCH3 
M  SVB   2 23   -0.3943   -0.7557 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  19  20 
M  SBL   1  1  21 
M  SMT   1  OCH3 
M  SVB   1 21    1.7467   -1.0314 
S  SKP  8 
ID	FLIAALNS0006 
KNApSAcK_ID	C00009484 
NAME	Robustigenin;5-Hydroxy-7,2',4',5'-tetramethoxyisoflavone 
CAS_RN	72545-39-2 
FORMULA	C19H18O7 
EXACTMASS	358.10525293 
AVERAGEMASS	358.34202000000005 
SMILES	c(c(OC)1)(OC)cc(c(C(C3=O)=COc(c23)cc(OC)cc2O)c1)OC 
M  END