Phyto4Health

Vitexin

Representations & DB's id
ChEBI: CHEBI:16954
ChEMBL: CHEMBL487417
PubChem: 5280441
IUPAC: 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
Standard InChI: InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1
Standard InChI Key: SGEWCQFRYRRZDC-VPRICQMDSA-N
SMILES: OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)c1c(O)cc(c2c1oc(cc2=O)c1ccc(cc1)O)O

Molecular propeties
AlogP: 0.09
Hydrogen bonds acceptors: 10
Hydrogen bonds donors: 7
Rotatable bonds: 3
Number of rings: 4
Molecular Weight: 432.11
Topological polar surface area: 177
Number of aromatic rings: 3
Fsp3: 0.286
Number of carbons: 21

Plant sources

Part of plant Plant name Ref.
PlantPanax ginseng
PlantCannabis sativa
PlantTrigonella foenum-graecum
SeedTrigonella foenum-graecum
StemTrigonella foenum-graecum
PlantTrigonella foenum-graecum
SeedTrigonella foenum-graecum
StemTrigonella foenum-graecum
PlantRosa davurica
PlantBeta vulgaris
PlantCrataegus oxyacantha
PlantMarrubium vulgare
LeafMarrubium vulgare

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
IC50566660 nMAldose reductaseP15121