Mol:FL5FACGA0011

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  43  44 
M  SBL   2  1  47 
M  SMT   2  CH2OH 
M  SVB   2 47   -3.1336   -1.2106 
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    2.8632    -0.418 
S  SKP  8 
ID	FL5FACGA0011 
KNApSAcK_ID	C00005419 
NAME	Quercetin 3,5-digalactoside 
CAS_RN	- 
FORMULA	C27H30O17 
EXACTMASS	626.148299534 
AVERAGEMASS	626.5169000000001 
SMILES	[C@@H](O1)(Oc(c5)c(c(cc(O)5)3)C(C(O[C@@H](C(O)4)O[C@H](CO)[C@@H](C(O)4)O)=C(O3)c(c2)ccc(O)c2O)=O)[C@H]([C@@H](O)[C@H](C1CO)O)O 
M  END