Phyto4Health

Kaempferol 7-O-Beta-D-Glucopyranoside

Representations & DB's id

ChEBI: CHEBI:75790
ChEMBL: CHEMBL469441
PubChem: 10095180
IUPAC: 3,5-dihydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Standard InChI: InChI=1S/C21H20O11/c22-7-13-15(25)17(27)19(29)21(32-13)30-10-5-11(24)14-12(6-10)31-20(18(28)16(14)26)8-1-3-9(23)4-2-8/h1-6,13,15,17,19,21-25,27-29H,7H2/t13-,15-,17+,19-,21-/m1/s1
Standard InChI Key: YPWHZCPMOQGCDQ-HMGRVEAOSA-N
SMILES: OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(c(c3=O)O)c2ccc(cc2)O)[C@@H]([C@H]([C@@H]1O)O)O

Molecular propeties

AlogP: -0.24
Hydrogen bonds acceptors: 11
Hydrogen bonds donors: 7
Rotatable bonds: 4
Number of rings: 4
Molecular Weight: 448.1
Topological polar surface area: 186
Number of aromatic rings: 3
Fsp3: 0.286
Number of carbons: 21

Plant sources

Part of plant Plant name Ref.
FlowerCrocus sativus
FlowerCrocus sativus
FlowerCrocus sativus

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.