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Mol:FL5FAAGL0034 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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25 51 1 0 0 0 0<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 47 48<br />
M SBL 1 1 53<br />
M SMT 1 CH2OH<br />
M SBV 1 53 0.0000 1.0215<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 49 50<br />
M SBL 2 1 55<br />
M SMT 2 CH2OH<br />
M SBV 2 55 -0.6253 -0.2241<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 51 52<br />
M SBL 3 1 57<br />
M SMT 3 CH2OH<br />
M SBV 3 57 -0.1095 1.2823<br />
S SKP 5<br />
ID FL5FAAGL0034<br />
FORMULA C32H38O20<br />
EXACTMASS 742.1956436559999<br />
AVERAGEMASS 742.63212<br />
SMILES C(C(O1)C(C(O)C(Oc(c6)cc(c2c6O)OC(c(c5)ccc(O)c5)=C(OC(O4)C(C(O)C(C(CO)4)O)OC(O3)C(C(O)C(C(CO)3)O)O)C2=O)1)O)O<br />
M END<br />
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