InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17-,19+,20-,23+/m1/s1

【InChIKey】

InChIKey=IGLUNMMNDNWZOA-LNNZMUSMSA-N

【SMILES】

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)Oc2c(=O)c3c(cc(cc3oc2c4ccc(c(c4)O)O)O)O)O)O)O

【MOL File】

QUERCETIN-3-O-BETA-D….mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:7

H bond acceptor:13

XLogP3:0.0

Bulk/Fine:FB

3Material Safety Data Sheet(MSDS)

4CML File

QUERCETIN-3-O-BETA-D-GLUCOPYRANOSYL-6''-ACETATE.cml

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54542-51-7 QUERCETIN-3-O-BETA-D-GLUCOPYRANOSYL-6''-ACETATE

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】