Mol:FL7AACGL0055

Latest revision as of 09:00, 14 March 2009

 
 
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  61  62 
M  SBL   2  1  66 
M  SMT   2  OCH3 
M  SVB   2 66    1.1477    -0.481 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  3  57  58  60 
M  SBL   1  1  62 
M  SMT   1  COOH 
M  SVB   1 62   -4.2681    0.3166 
S  SKP  8 
ID	FL7AACGL0055 
KNApSAcK_ID	C00006826 
NAME	Cyanidin 3-(6''-ferulylglucoside)-5-(6'''-malonylglucoside) 
CAS_RN	123453-03-2 
FORMULA	C40H41O22 
EXACTMASS	873.208947996 
AVERAGEMASS	873.7403400000001 
SMILES	c(c6)(c(cc(c6)C=CC(OC[C@H]([C@H](O)5)O[C@H](C(O)C(O)5)Oc(c3c(c4)cc(c(O)c4)O)cc(c([o+1]3)1)c(O[C@H](O2)[C@H]([C@@H](O)[C@H](C(COC(=O)CC(O)=O)2)O)O)cc(O)c1)=O)OC)O 
M  END
Mol:FL7AACGL0055

Latest revision as of 09:00, 14 March 2009

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