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Mol:FL5FCCGL0002 - Revision history
2026-05-17T04:56:39Z
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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 />
44 48 0 0 0 0 0 0 0 0999 V2000<br />
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16 17 2 0 0 0 0<br />
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3 18 1 0 0 0 0<br />
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16 40 1 0 0 0 0<br />
1 41 1 0 0 0 0<br />
41 42 1 0 0 0 0<br />
24 43 1 0 0 0 0<br />
43 44 1 0 0 0 0<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 43 44<br />
M SBL 2 1 47<br />
M SMT 2 CH2OH<br />
M SVB 2 47 0.7866 -2.6145<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 41 42<br />
M SBL 1 1 45<br />
M SMT 1 OCH3<br />
M SVB 1 45 -2.7813 1.859<br />
S SKP 8<br />
ID FL5FCCGL0002<br />
KNApSAcK_ID C00005513<br />
NAME Rhamnetin 3-neohesperidoside<br />
CAS_RN 101330-77-2<br />
FORMULA C28H32O16<br />
EXACTMASS 624.1690349759999<br />
AVERAGEMASS 624.54408<br />
SMILES [C@@H]([C@H](O)1)([C@@H](C(C)O[C@@H]1OC([C@H](OC(=C4c(c5)cc(c(c5)O)O)C(c(c(O4)3)c(cc(c3)OC)O)=O)2)C(O)[C@@H](O)[C@@H](CO)O2)O)O<br />
M END<br />
</pre></div>
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