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Mol:FL7AACGL0018 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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34 49 1 0 0 0 0<br />
51 52 1 0 0 0 0<br />
45 51 1 0 0 0 0<br />
53 54 1 0 0 0 0<br />
23 53 1 0 0 0 0<br />
M CHG 1 10 1<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 49 50<br />
M SBL 1 1 55<br />
M SMT 1 CH2OH<br />
M SBV 1 55 -0.7209 -0.2418<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 51 52<br />
M SBL 2 1 57<br />
M SMT 2 ^ CH2OH<br />
M SBV 2 57 0.3831 -0.5327<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 53 54<br />
M SBL 3 1 59<br />
M SMT 3 ^ CH2OH<br />
M SBV 3 59 0.0325 0.7407<br />
S SKP 5<br />
ID FL7AACGL0018<br />
FORMULA C33H41O21<br />
EXACTMASS 773.214033374<br />
AVERAGEMASS 773.66604<br />
SMILES OCC(O1)C(O)C(C(O)C1Oc(c6)c(c3)c(cc(O)6)[o+1]c(c(OC(C4OC(C(O)5)OC(CO)C(O)C5O)OC(C(O)C4O)CO)3)c(c2)cc(c(O)c2)O)O<br />
M END<br />
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