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Mol:FL5FCAGL0006 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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32 52 1 0 0 0 0<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 46 47<br />
M SBL 1 1 52<br />
M SMT 1 CH2OH<br />
M SBV 1 52 0.0000 1.2050<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 48 49<br />
M SBL 2 1 54<br />
M SMT 2 ^ OCH3<br />
M SBV 2 54 0.7091 -0.4094<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 50 51<br />
M SBL 3 1 56<br />
M SMT 3 CH2OH<br />
M SBV 3 56 -0.7843 0.2102<br />
M STY 1 4 SUP<br />
M SLB 1 4 4<br />
M SAL 4 2 52 53<br />
M SBL 4 1 58<br />
M SMT 4 CH2OH<br />
M SBV 4 58 0.0000 0.6629<br />
S SKP 5<br />
ID FL5FCAGL0006<br />
FORMULA C33H40O20<br />
EXACTMASS 756.21129372<br />
AVERAGEMASS 756.6587<br />
SMILES C(O6)(C(C(C(O)C6CO)O)O)Oc(c1)ccc(C(=C(OC(C(OC(O5)C(O)C(O)(CO)C5)4)OC(C(O)C(O)4)CO)3)Oc(c2C3=O)cc(cc2O)OC)c1<br />
M END<br />
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