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Mol:FL5FAAGS0085 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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6 1 1 0 0 0 0<br />
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8 9 1 0 0 0 0<br />
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5 20 1 0 0 0 0<br />
16 21 1 0 0 0 0<br />
22 23 1 0 0 0 0<br />
23 24 1 1 0 0 0<br />
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26 25 1 1 0 0 0<br />
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27 22 1 0 0 0 0<br />
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22 31 1 0 0 0 0<br />
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35 34 1 1 0 0 0<br />
35 36 1 0 0 0 0<br />
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32 38 1 0 0 0 0<br />
33 39 1 0 0 0 0<br />
34 40 1 0 0 0 0<br />
35 29 1 0 0 0 0<br />
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44 28 1 0 0 0 0<br />
50 51 1 0 0 0 0<br />
37 50 1 0 0 0 0<br />
52 53 1 0 0 0 0<br />
46 52 1 0 0 0 0<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 50 51<br />
M SBL 1 1 56<br />
M SMT 1 ^ CH2OH<br />
M SBV 1 56 0.8677 -0.2250<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 52 53<br />
M SBL 2 1 58<br />
M SMT 2 ^ CH2OH<br />
M SBV 2 58 0.3853 0.6805<br />
S SKP 5<br />
ID FL5FAAGS0085<br />
FORMULA C33H40O20<br />
EXACTMASS 756.21129372<br />
AVERAGEMASS 756.6587<br />
SMILES C(C(OC(C2OC(C6O)OC(CO)C(O)C6O)C(OC(C(=O)3)=C(c(c5)ccc(O)c5)Oc(c4)c(c(O)cc4O)3)OC(C2O)C)1)(O)C(O)C(C(CO)O1)O<br />
M END<br />
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