Mol:FL7AACGL0014

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  40  41 
M  SBL   1  1  44 
M  SMT   1 CH2OH 
M  SBV   1 44   -7.5297    5.0366 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  42  43 
M  SBL   2  1  46 
M  SMT   2 CH2OH 
M  SBV   2 46   -7.5297    5.0366 
S  SKP  8 
ID	FL7AACGL0014 
KNApSAcK_ID	C00006669 
NAME	Cyanidin 3,4'-diglucoside 
CAS_RN	27459-78-5 
FORMULA	C27H31O16 
EXACTMASS	611.161209944 
AVERAGEMASS	611.52544 
SMILES	O(C(O5)C(C(C(O)C(CO)5)O)O)c(c1)c(cc(c([o+1]2)c(OC(O4)C(C(O)C(C4CO)O)O)cc(c3O)c2cc(O)c3)c1)O 
M  END