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Mol:FL7AACGL0010 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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3 19 1 0 0 0 0<br />
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40 41 2 0 0 0 0<br />
40 42 1 0 0 0 0<br />
34 40 1 0 0 0 0<br />
43 44 1 0 0 0 0<br />
22 43 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 3 40 41 42<br />
M SBL 1 1 46<br />
M SMT 1 COOH<br />
M SBV 1 46 -0.6541 -0.2166<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 0.0419 0.6696<br />
S SKP 5<br />
ID FL7AACGL0010<br />
FORMULA C27H29O17<br />
EXACTMASS 625.140474502<br />
AVERAGEMASS 625.50896<br />
SMILES Oc(c(O)1)ccc(c(c(OC(C4OC(O5)C(O)C(C(C5C(O)=O)O)O)OC(CO)C(C(O)4)O)3)[o+1]c(c2c3)cc(O)cc2O)c1<br />
M END<br />
</pre></div>
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