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Mol:FL5FFCGA0006 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 35 36<br />
M SBL 3 1 38<br />
M SMT 3 CH2OH<br />
M SVB 3 38 3.0947 -1.9612<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 33 34<br />
M SBL 2 1 36<br />
M SMT 2 OCH3<br />
M SVB 2 36 1.0931 1.9612<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 31 32<br />
M SBL 1 1 34<br />
M SMT 1 OCH3<br />
M SVB 1 34 -1.7042 0.9762<br />
S SKP 8<br />
ID FL5FFCGA0006<br />
KNApSAcK_ID C00005714<br />
NAME Limocitrin 3-galactoside<br />
CAS_RN 103839-19-6<br />
FORMULA C23H24O13<br />
EXACTMASS 508.121690854<br />
AVERAGEMASS 508.42886<br />
SMILES O(c(c(O)4)cc(cc4)C(=C(O[C@H](O3)C(O)C([C@H]([C@@H](CO)3)O)O)2)Oc(c1C2=O)c(OC)c(cc(O)1)O)C<br />
M END<br />
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