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Mol:FL5FGCNS0020 - 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 />
30 33 0 0 0 0 0 0 0 0999 V2000<br />
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1.8112 0.1497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
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15 27 1 0 0 0 0<br />
27 28 1 0 0 0 0<br />
8 29 1 0 0 0 0<br />
29 30 1 0 0 0 0<br />
M STY 1 5 SUP<br />
M SLB 1 5 5<br />
M SAL 5 2 29 30<br />
M SBL 5 1 32<br />
M SMT 5 OCH3<br />
M SVB 5 32 0.3315 -0.9987<br />
M STY 1 4 SUP<br />
M SLB 1 4 4<br />
M SAL 4 2 27 28<br />
M SBL 4 1 30<br />
M SMT 4 OCH3<br />
M SVB 4 30 2.378 1.1317<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 25 26<br />
M SBL 3 1 28<br />
M SMT 3 OCH3<br />
M SVB 3 28 -1.2697 0.7229<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 23 24<br />
M SBL 2 1 26<br />
M SMT 2 OCH3<br />
M SVB 2 26 1.5277 1.7079<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 21 22<br />
M SBL 1 1 24<br />
M SMT 1 OCH3<br />
M SVB 1 24 -1.9841 -1.2954<br />
S SKP 8<br />
ID FL5FGCNS0020<br />
KNApSAcK_ID C00005062<br />
NAME Melicophyllin<br />
CAS_RN 119968-22-8<br />
FORMULA C21H20O9<br />
EXACTMASS 416.11073223799997<br />
AVERAGEMASS 416.37809999999996<br />
SMILES C(O1)Oc(c(OC)2)c1c(OC)c(O3)c2C(C(=C(c(c4)cc(c(c4)OC)OC)3)OC)=O<br />
M END<br />
</pre></div>
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