Mol:FL3FACDS0005

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  45 
M  SMT   1 ^CH2OH 
M  SBV   1  45    0.4534   -0.4960 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  42  43 
M  SBL   2  1  47 
M  SMT   2 CH2OH 
M  SBV   2  47   -0.6495    0.0000 
S  SKP  5 
ID	FL3FACDS0005 
FORMULA	C27H30O16 
EXACTMASS	610.153384912 
AVERAGEMASS	610.5175 
SMILES	OCC(O1)C(O)C(O)C(C(c(c5O)c(O)cc(c25)OC(c(c3)ccc(OC(O4)C(C(C(O)C(CO)4)O)O)c(O)3)=CC2=O)1)O 
M  END