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Mol:FL5FELNS0016 - Revision history
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<p><b>New page</b></p><div><pre><br />
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Copyright: ARM project http://www.metabolome.jp/<br />
29 31 0 0 0 0 0 0 0 0999 V2000<br />
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-3.1776 1.4903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
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6 1 2 0 0 0 0<br />
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24 25 1 0 0 0 0<br />
15 26 1 0 0 0 0<br />
26 27 1 0 0 0 0<br />
1 28 1 0 0 0 0<br />
28 29 1 0 0 0 0<br />
M STY 1 5 SUP<br />
M SLB 1 5 5<br />
M SAL 5 2 28 29<br />
M SBL 5 1 30<br />
M SMT 5 OCH3<br />
M SVB 5 30 -2.6775 0.6243<br />
M STY 1 4 SUP<br />
M SLB 1 4 4<br />
M SAL 4 2 26 27<br />
M SBL 4 1 28<br />
M SMT 4 OCH3<br />
M SVB 4 28 2.1618 1.3086<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 24 25<br />
M SBL 3 1 26<br />
M SMT 3 OCH3<br />
M SVB 3 26 0.1038 -0.843<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 22 23<br />
M SBL 2 1 24<br />
M SMT 2 OCH3<br />
M SVB 2 24 1.8046 0.1204<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 20 21<br />
M SBL 1 1 22<br />
M SMT 1 OCH3<br />
M SVB 1 22 0.1038 1.6001<br />
S SKP 8<br />
ID FL5FELNS0016<br />
KNApSAcK_ID C00004819<br />
NAME Distemonatin<br />
CAS_RN 78368-30-6<br />
FORMULA C20H20O9<br />
EXACTMASS 404.11073223799997<br />
AVERAGEMASS 404.3674<br />
SMILES COc(c1)c(C(O2)=C(C(c(c(O)3)c2cc(OC)c3O)=O)OC)cc(OC)c1OC<br />
M END<br />
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