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Mol:FLIAFLGS0001 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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35 36 1 0 0 0 0<br />
16 37 1 0 0 0 0<br />
37 38 1 0 0 0 0<br />
M STY 1 5 SUP<br />
M SLB 1 5 5<br />
M SAL 5 2 29 30<br />
M SBL 5 1 32<br />
M SMT 5 CH2OH<br />
M SVB 5 32 -3.2957 1.7141<br />
M STY 1 4 SUP<br />
M SLB 1 4 4<br />
M SAL 4 2 37 38<br />
M SBL 4 1 40<br />
M SMT 4 OCH3<br />
M SVB 4 40 3.2359 -1.0304<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 35 36<br />
M SBL 3 1 38<br />
M SMT 3 OCH3<br />
M SVB 3 38 2.7662 0.7025<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 33 34<br />
M SBL 2 1 36<br />
M SMT 2 OCH3<br />
M SVB 2 36 2.0517 -1.3016<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 31 32<br />
M SBL 1 1 34<br />
M SMT 1 OCH3<br />
M SVB 1 34 -0.0687 1.7053<br />
S SKP 8<br />
ID FLIAFLGS0001<br />
KNApSAcK_ID C00010139<br />
NAME Isocaviunin 7-O-glucoside;Isocaviudin<br />
CAS_RN 74148-49-5<br />
FORMULA C25H28O13<br />
EXACTMASS 536.152990982<br />
AVERAGEMASS 536.48202<br />
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<br />
M END<br />
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