Mol:FLIAFLGS0001

Latest revision as of 09:00, 14 March 2009

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   5 SUP 
M  SLB  1   5   5 
M  SAL   5  2  29  30 
M  SBL   5  1  32 
M  SMT   5  CH2OH 
M  SVB   5 32   -3.2957    1.7141 
M  STY  1   4 SUP 
M  SLB  1   4   4 
M  SAL   4  2  37  38 
M  SBL   4  1  40 
M  SMT   4  OCH3 
M  SVB   4 40    3.2359   -1.0304 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  35  36 
M  SBL   3  1  38 
M  SMT   3  OCH3 
M  SVB   3 38    2.7662    0.7025 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  33  34 
M  SBL   2  1  36 
M  SMT   2  OCH3 
M  SVB   2 36    2.0517   -1.3016 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  31  32 
M  SBL   1  1  34 
M  SMT   1  OCH3 
M  SVB   1 34   -0.0687    1.7053 
S  SKP  8 
ID	FLIAFLGS0001 
KNApSAcK_ID	C00010139 
NAME	Isocaviunin 7-O-glucoside;Isocaviudin 
CAS_RN	74148-49-5 
FORMULA	C25H28O13 
EXACTMASS	536.152990982 
AVERAGEMASS	536.48202 
SMILES	O=C(c21)C(c(c4OC)cc(c(c4)OC)OC)=COc(c(c(O[C@@H]([C@H]3O)OC(CO)[C@H](O)[C@@H]3O)cc(O)2)OC)1 
M  END