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Mol:FL5FECGL0012 - 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 44 45<br />
M SBL 3 1 48<br />
M SMT 3 CH2OH<br />
M SVB 3 48 1.3577 -1.0393<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 46 47<br />
M SBL 2 1 50<br />
M SMT 2 OCH3<br />
M SVB 2 50 1.1245 2.6308<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 -3.2216 0.2007<br />
S SKP 8<br />
ID FL5FECGL0012<br />
KNApSAcK_ID C00005668<br />
NAME Spinacetin 3-gentiobioside<br />
CAS_RN 101021-29-8<br />
FORMULA C29H34O18<br />
EXACTMASS 670.174514284<br />
AVERAGEMASS 670.5694599999999<br />
SMILES c(c1)c(O)c(cc(C(=C(O[C@@H](C4O)O[C@H](CO[C@@H]([C@@H](O)5)OC(CO)[C@H](O)[C@@H]5O)[C@@H](C4O)O)2)Oc(c3)c(c(O)c(OC)c(O)3)C2=O)1)OC<br />
M END<br />
</pre></div>
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