Mol:FL5FECGS0008

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  32  33 
M  SBL   2  1  35 
M  SMT   2  CH2OH 
M  SVB   2 35   -2.5239   -0.8175 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  34  35 
M  SBL   1  1  37 
M  SMT   1  OCH3 
M  SVB   1 37    -1.907   -0.1272 
S  SKP  8 
ID	FL5FECGS0008 
KNApSAcK_ID	C00005642 
NAME	Patuletin 5-glucoside 
CAS_RN	83086-28-6 
FORMULA	C22H22O13 
EXACTMASS	494.10604078999995 
AVERAGEMASS	494.40228 
SMILES	COc(c(O[C@H](O4)[C@@H](O)[C@H]([C@H](C(CO)4)O)O)1)c(cc(O2)c1C(C(O)=C2c(c3)ccc(c3O)O)=O)O 
M  END