Phyto4Health

Apigenin-7-O-Glucoside

Representations & DB's id

ChEBI: None
ChEMBL: CHEMBL2165585
PubChem: 12304093
IUPAC: 5-hydroxy-2-(4-hydroxyphenyl)-7-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Standard InChI: InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21?/m1/s1
Standard InChI Key: KMOUJOKENFFTPU-MKJMBMEGSA-N
SMILES: OC[C@H]1OC(Oc2cc(O)c3c(c2)oc(cc3=O)c2ccc(cc2)O)[C@@H]([C@H]([C@@H]1O)O)O

Molecular propeties

AlogP: 0.05
Hydrogen bonds acceptors: 10
Hydrogen bonds donors: 6
Rotatable bonds: 4
Number of rings: 4
Molecular Weight: 432.11
Topological polar surface area: 166
Number of aromatic rings: 3
Fsp3: 0.286
Number of carbons: 21

Plant sources

Part of plant Plant name Ref.
PlantHypericum perforatum
PlantThymus vulgaris

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.