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Mol:FL5FACGL0036 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 54 55<br />
M SBL 2 1 59<br />
M SMT 2 CH2OH<br />
M SVB 2 59 -3.7708 1.2765<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 52 53<br />
M SBL 1 1 57<br />
M SMT 1 CH2OH<br />
M SVB 1 57 2.7745 -1.4682<br />
S SKP 8<br />
ID FL5FACGL0036<br />
KNApSAcK_ID C00005467<br />
NAME Quercetin 3-gentiobioside-7-glucoside<br />
CAS_RN 84534-23-6<br />
FORMULA C33H40O22<br />
EXACTMASS 788.201122964<br />
AVERAGEMASS 788.6575<br />
SMILES O(C=3c(c6)ccc(O)c(O)6)c(c(C(C3O[C@@H](C4O)O[C@H](CO[C@H](O5)[C@H]([C@@H](O)[C@H](C(CO)5)O)O)[C@H](O)C(O)4)=O)2)cc(cc2O)O[C@@H]([C@@H](O)1)OC(CO)[C@H](O)[C@@H]1O<br />
M END<br />
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