Mol:FLIAGCNS0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 28 31  0  0  0  0  0  0  0  0999 V2000 
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   -0.2145   -0.0420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3418    0.2791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    2.3185   -1.8157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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  3  4  1  0  0  0  0 
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  5  6  1  0  0  0  0 
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  7  8  1  0  0  0  0 
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M  STY  1   4 SUP 
M  SLB  1   4   4 
M  SAL   4  2  27  28 
M  SBL   4  1  30 
M  SMT   4  OCH3 
M  SVB   4 30   -2.2406    1.5402 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  25  26 
M  SBL   3  1  28 
M  SMT   3  OCH3 
M  SVB   3 28    -1.049    1.8157 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  23  24 
M  SBL   2  1  26 
M  SMT   2  OCH3 
M  SVB   2 26   -1.7635   -0.2026 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  21  22 
M  SBL   1  1  24 
M  SMT   1  OCH3 
M  SVB   1 24   -2.5979    0.3706 
S  SKP  8 
ID	FLIAGCNS0001 
KNApSAcK_ID	C00009491 
NAME	5,6,7,8-Tetramethoxy-3',4'-methylenedioxyisoflavone 
CAS_RN	51986-38-0 
FORMULA	C20H18O8 
EXACTMASS	386.100167552 
AVERAGEMASS	386.35212 
SMILES	O(C)c(c12)c(c(c(OC)c1C(C(c(c4)cc(O3)c(c4)OC3)=CO2)=O)OC)OC 
M  END