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Mol:FL3FACGS0037 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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40 41 2 0 0 0 0<br />
40 42 1 0 0 0 0<br />
27 40 1 0 0 0 0<br />
43 44 1 0 0 0 0<br />
34 43 1 0 0 0 0<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 3 40 41 42<br />
M SBL 1 1 46<br />
M SMT 1 ^COOH<br />
M SBV 1 46 0.6026 -0.2060<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 43 44<br />
M SBL 2 1 48<br />
M SMT 2 CH2OH<br />
M SBV 2 48 -0.5572 -0.0290<br />
S SKP 5<br />
ID FL3FACGS0037<br />
FORMULA C27H28O17<br />
EXACTMASS 624.1326494699999<br />
AVERAGEMASS 624.50102<br />
SMILES O(c13)C(c(c4)cc(O)c(OC(O5)C(C(C(O)C(CO)5)O)O)c4)=CC(=O)c(c(cc(c3)OC(O2)C(C(C(O)C2C(O)=O)O)O)O)1<br />
M END<br />
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