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Mol:FL5FECGL0013 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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M STY 1 4 SUP<br />
M SLB 1 4 4<br />
M SAL 4 2 30 31<br />
M SBL 4 1 33<br />
M SMT 4 CH2OH<br />
M SVB 4 33 2.8858 -1.3752<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 36 37<br />
M SBL 3 1 39<br />
M SMT 3 OCH3<br />
M SVB 3 39 1.5963 1.2114<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 34 35<br />
M SBL 2 1 37<br />
M SMT 2 OCH3<br />
M SVB 2 37 -3.6002 -0.6425<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 32 33<br />
M SBL 1 1 35<br />
M SMT 1 OCH3<br />
M SVB 1 35 0.7459 1.7877<br />
S SKP 8<br />
ID FL5FECGL0013<br />
KNApSAcK_ID C00005680<br />
NAME Quercetagetin 6,3',4'-trimethyl ether 3-glucoside<br />
CAS_RN 144599-13-3<br />
FORMULA C24H26O13<br />
EXACTMASS 522.137340918<br />
AVERAGEMASS 522.45544<br />
SMILES OC([C@@H]1OC(C(=O)2)=C(c(c4)cc(OC)c(OC)c4)Oc(c3)c(c(c(OC)c(O)3)O)2)C([C@@H](O)[C@@H](CO)O1)O<br />
M END<br />
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