Mol:FL63ACNS0010

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 33 36  0  0  0  0  0  0  0  0999 V2000 
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M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  32  33 
M  SBL   1  1  35 
M  SMT   1  OCH3 
M  SVB   1 35    2.0975   -2.0157 
S  SKP  8 
ID	FL63ACNS0010 
KNApSAcK_ID	C00008870 
NAME	Epicatechin 3-O-(4-O-methylgallate) 
CAS_RN	108907-44-4 
FORMULA	C23H20O10 
EXACTMASS	456.10564686 
AVERAGEMASS	456.3989 
SMILES	c(c1)(O)cc(O2)c(C[C@@H](OC(c(c4)cc(c(OC)c(O)4)O)=O)[C@H]2c(c3)ccc(c3O)O)c(O)1 
M  END