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Mol:FLIA1AGS0014 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
40 44 0 0 0 0 0 0 0 0999 V2000<br />
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24 37 1 0 0 0 0<br />
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16 39 1 0 0 0 0<br />
39 40 1 0 0 0 0<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 37 38<br />
M SBL 2 1 41<br />
M SMT 2 CH2OH<br />
M SVB 2 41 -3.0958 2.2049<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 39 40<br />
M SBL 1 1 43<br />
M SMT 1 OCH3<br />
M SVB 1 43 3.4832 -0.4144<br />
S SKP 8<br />
ID FLIA1AGS0014<br />
KNApSAcK_ID C00010159<br />
NAME Formononetin 7-O-(2''-p-hydroxybenzoylglucoside)<br />
CAS_RN 122130-27-2<br />
FORMULA C29H26O11<br />
EXACTMASS 550.147511674<br />
AVERAGEMASS 550.51014<br />
SMILES OCC([C@H](O)1)O[C@@H](Oc(c3)ccc(C4=O)c(OC=C4c(c5)ccc(c5)OC)3)[C@@H](OC(c(c2)ccc(c2)O)=O)[C@H]1O<br />
M END<br />
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