Mol:FL63ACGS0003

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  41  42 
M  SBL   1  1  45 
M  SMT   1  CH2OH 
M  SVB   1 45   -1.1412   -1.3344 
S  SKP  8 
ID	FL63ACGS0003 
KNApSAcK_ID	C00008839 
NAME	Epicatechin 3-O-(2-trans-cinnamoyl-beta-D-allopyranoside) 
CAS_RN	98752-08-0 
FORMULA	C30H30O12 
EXACTMASS	582.173726424 
AVERAGEMASS	582.552 
SMILES	Oc(c5)cc(O1)c(c5O)C[C@H](O[C@@H]([C@@H](OC(C=Cc(c4)cccc4)=O)3)OC(CO)[C@@H]([C@H](O)3)O)[C@H]1c(c2)ccc(O)c(O)2 
M  END