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Mol:FL7AADGL0027 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
42 46 0 0 0 0 0 0 0 0999 V2000<br />
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5 18 1 0 0 0 0<br />
1 19 1 0 0 0 0<br />
8 20 1 0 0 0 0<br />
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25 26 1 1 0 0 0<br />
27 26 1 1 0 0 0<br />
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28 29 1 0 0 0 0<br />
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34 35 1 0 0 0 0<br />
35 36 1 0 0 0 0<br />
36 37 1 0 0 0 0<br />
37 38 1 1 0 0 0<br />
38 33 1 1 0 0 0<br />
35 39 1 0 0 0 0<br />
36 40 1 0 0 0 0<br />
20 37 1 0 0 0 0<br />
23 34 1 0 0 0 0<br />
41 42 1 0 0 0 0<br />
33 41 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 2 41 42<br />
M SBL 1 1 46<br />
M SMT 1 ^ CH2OH<br />
M SBV 1 46 0.0194 0.7687<br />
S SKP 5<br />
ID FL7AADGL0027<br />
FORMULA C27H31O15<br />
EXACTMASS 595.166295322<br />
AVERAGEMASS 595.52604<br />
SMILES COc(c(O)1)cc(c([o+1]3)c(OC(O5)C(O)C(C(C5CO)OC(C(O)4)OCC(O)C4O)O)cc(c32)c(cc(O)c2)O)cc1<br />
M END<br />
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