Mol:FL5FECGS0017

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  31  32 
M  SBL   3  1  34 
M  SMT   3  CH2OH 
M  SVB   3 34    3.2053    1.0986 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  35  36 
M  SBL   2  1  38 
M  SMT   2  OCH3 
M  SVB   2 38   -3.7209    0.3444 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  33  34 
M  SBL   1  1  36 
M  SMT   1  OCH3 
M  SVB   1 36   -0.9396   -1.1229 
S  SKP  8 
ID	FL5FECGS0017 
KNApSAcK_ID	C00005659 
NAME	Tomentin 4'-glucoside 
CAS_RN	71827-17-3 
FORMULA	C23H24O13 
EXACTMASS	508.121690854 
AVERAGEMASS	508.42886 
SMILES	Oc(c4OC)c(O)c(c1c4)C(C(OC)=C(c(c2)ccc(O[C@@H](C(O)3)O[C@H](CO)[C@@H](C3O)O)c2O)O1)=O 
M  END