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Mol:FL5FACGL0055 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 43 44<br />
M SBL 1 1 47<br />
M SMT 1 CH2OH<br />
M SVB 1 47 2.4903 0.335<br />
S SKP 8<br />
ID FL5FACGL0055<br />
KNApSAcK_ID C00005957<br />
NAME Quercetin 3-(2''-galloylglucoside)<br />
CAS_RN 69624-79-9<br />
FORMULA C28H24O16<br />
EXACTMASS 616.1064347199999<br />
AVERAGEMASS 616.48056<br />
SMILES O[C@@H]([C@@H](O)4)C(O[C@@H]([C@@H]4OC(=O)c(c5)cc(O)c(O)c5O)OC(C(=O)1)=C(c(c3)cc(c(c3)O)O)Oc(c2)c(c(cc(O)2)O)1)CO<br />
M END<br />
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