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Mol:FL3FACDS0011 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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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 0.5295 -0.5295<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 0.5906 -0.5906<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 -0.3329 -0.5766<br />
S SKP 5<br />
ID FL3FACDS0011<br />
FORMULA C33H40O21<br />
EXACTMASS 772.206208342<br />
AVERAGEMASS 772.6581<br />
SMILES OC(C1OC(C(O)6)OC(CO)C(C(O)6)O)C(O)C(CO)OC1c(c(O)2)c(cc(O3)c2C(=O)C=C3c(c4)ccc(OC(O5)C(C(C(C5CO)O)O)O)c4O)O<br />
M END<br />
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