Mol:FL3FEAGS0021

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  33  34 
M  SBL   3  1  36 
M  SMT   3  CH2OH 
M  SVB   3 36    -3.238    0.5624 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  31  32 
M  SBL   2  1  34 
M  SMT   2  OCH3 
M  SVB   2 34   -0.9001   -0.3264 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  29  30 
M  SBL   1  1  32 
M  SMT   1  OCH3 
M  SVB   1 32     3.687    1.1309 
S  SKP  8 
ID	FL3FEAGS0021 
KNApSAcK_ID	C00004237 
NAME	Pectolinarigenin 7-glucoside 
CAS_RN	53452-12-3 
FORMULA	C23H24O11 
EXACTMASS	476.13186161 
AVERAGEMASS	476.43006 
SMILES	c(c1)(O3)c(C(=O)C=C(c(c4)ccc(OC)c4)3)c(c(c1O[C@@H]([C@@H](O)2)OC(CO)[C@@H]([C@@H]2O)O)OC)O 
M  END