Kaempferol-4'-O-β-D-glucopyranoside
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Kaempferol-4'-O-β-D-glucopyranoside

CAS 52222-74-9
Synonyms 4H-1-Benzopyran-4-one, 2-[4-(β-D-glucopyranosyloxy)phenyl]-3,5,7-trihydroxy-
IUPAC Name 3,5,7-Trihydroxy-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
Molecular Weight 448.38
Molecular Formula C21H20O11
Canonical SMILES C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O
InChI InChI=1S/C21H20O11/c22-7-13-15(25)17(27)19(29)21(32-13)30-10-3-1-8(2-4-10)20-18(28)16(26)14-11(24)5-9(23)6-12(14)31-20/h1-6,13,15,17,19,21-25,27-29H,7H2/t13-,15-,17+,19-,21-/m1/s1
InChI Key AUCGRWHWAGXNQS-HMGRVEAOSA-N
Boiling Point 784.5±60.0 °C
Melting Point 223-225 °C
Purity 98%
Density 1.736 g/ml
pKa 6.32±0.40
Appearance Powder

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