Mol:FL3FCBCS0002

Latest revision as of 09:00, 14 March 2009

 
 
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  28  29 
M  SBL   3  1  31 
M  SMT   3  CH2OH 
M  SVB   3 31    -1.426    1.5845 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  32  33 
M  SBL   2  1  35 
M  SMT   2  OCH3 
M  SVB   2 35   -2.8366    -0.338 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  30  31 
M  SBL   1  1  33 
M  SMT   1  OCH3 
M  SVB   1 33    2.1221    0.4001 
S  SKP  8 
ID	FL3FCBCS0002 
KNApSAcK_ID	C00006148 
NAME	Isoembigenin;8-beta-D-Glucopyranosyl-5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one 
CAS_RN	20943-11-7 
FORMULA	C23H24O10 
EXACTMASS	460.136946988 
AVERAGEMASS	460.43066 
SMILES	c(c1)c(ccc1C(=C3)Oc(c2[C@H](O4)[C@@H](O)[C@@H](O)[C@H](C4CO)O)c(C3=O)c(O)cc2OC)OC 
M  END