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Mol:FLIAEAGS0006 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 40 41<br />
M SBL 3 1 44<br />
M SMT 3 CH2OH<br />
M SVB 3 44 1.5983 -1.0063<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 44 45<br />
M SBL 2 1 48<br />
M SMT 2 OCH3<br />
M SVB 2 48 -3.5656 2.4123<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 42 43<br />
M SBL 1 1 46<br />
M SMT 1 OCH3<br />
M SVB 1 46 -3.9229 1.2521<br />
S SKP 8<br />
ID FLIAEAGS0006<br />
KNApSAcK_ID C00010127<br />
NAME 7-O-Methyltectorigenin 4'-O-gentiobioside<br />
CAS_RN 68418-92-8<br />
FORMULA C29H34O16<br />
EXACTMASS 638.18468504<br />
AVERAGEMASS 638.57066<br />
SMILES c(c1)(OC)c(c(O)c(C(=O)2)c1OC=C2c(c3)ccc(O[C@H](O4)C(O)C([C@@H](O)[C@@H](CO[C@@H]([C@@H](O)5)OC([C@H](O)[C@@H]5O)CO)4)O)c3)OC<br />
M END<br />
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