Mol:FLIA1AGS0002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  30  31 
M  SBL   2  1  33 
M  SMT   2  CH2OH 
M  SVB   2 33   -2.6805     0.914 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  28  29 
M  SBL   1  1  31 
M  SMT   1  OCH3 
M  SVB   1 31    2.9567   -0.7426 
S  SKP  8 
ID	FLIA1AGS0002 
KNApSAcK_ID	C00002553 
NAME	Ononin;Formononetin 7-O-glucoside 
CAS_RN	486-62-4 
FORMULA	C22H22O9 
EXACTMASS	430.126382302 
AVERAGEMASS	430.40468000000004 
SMILES	c(c1)c(ccc1C(C(=O)4)=COc(c42)cc(O[C@@H]([C@@H](O)3)OC(CO)[C@H](O)[C@@H]3O)cc2)OC 
M  END