Kaempferol-3-O-(6′′-galloyl)-β-glucopyranoside

Category	Human immunodeficiency Virus (HIV)
CAS	56317-05-6

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Synonyms	56317-05-6;Kaempferol 3-O-(6''-galloyl)-beta-D-glucopyranoside;Astragalin 6''-gallate;[(2R,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate;Kaempferol-3-O-(6 inverted exclamation marka inverted exclamation marka-galloyl)-\|A-glucopyranoside;CHEMBL503183;DTXSID50204859;HY-N10776;AKOS040763590;FS-7713;DA-64698;CS-0636020;Kaempferol-3-O-(6a(2)a?galloyl)-I(2)-glucopyranoside;[(2R,3S,4S,5R,6S)-6-{[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate;4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-((6-O-(3,4,5- trihydroxybenzoyl)-beta-D-glucopyranosyl)oxy)-;
IUPAC Name	[(2R,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate
Molecular Weight	454.7
Molecular Formula	C30H46O3
Canonical SMILES	C[C@]12CCC(=O)C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C
InChI	InChI=1S/C28H24O15/c29-12-3-1-10(2-4-12)25-26(22(36)19-14(31)7-13(30)8-17(19)41-25)43-28-24(38)23(37)21(35)18(42-28)9-40-27(39)11-5-15(32)20(34)16(33)6-11/h1-8,18,21,23-24,28-35,37-38H,9H2/t18-,21-,23+,24-,28+/m1/s1
InChIKey	STMNAPXMGWBZSF-OAYLZIFXSA-N
Appearance	Solid
Storage	-20°C, protect from light *In solvent : -80°C, 6 months; -20°C, 1 month (protect from light)