Mol:FL7AACGL0044

Latest revision as of 09:00, 14 March 2009

 
 
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  48  49 
M  SBL   1  1  52 
M  SMT   1 ^CH2OH 
M  SBV   1 52   -6.3245    5.5759 
S  SKP  8 
ID	FL7AACGL0044 
KNApSAcK_ID	C00006815 
NAME	Cyanidin 3-(6''-malonylglucoside)-5-glucoside 
CAS_RN	104055-86-9 
FORMULA	C30H33O19 
EXACTMASS	697.161603874 
AVERAGEMASS	697.57162 
SMILES	c(c(O)5)(cc(cc5)c(c(OC(O4)C(C(C(C4COC(CC(O)=O)=O)O)O)O)1)[o+1]c(c3)c(c(cc3O)OC(O2)C(C(O)C(O)C2CO)O)c1)O 
M  END