Phyto4Health

Hispiduloside

Representations & DB's id

ChEBI: None
ChEMBL: CHEMBL480657
PubChem: 5318083
IUPAC: 5-hydroxy-2-(4-hydroxyphenyl)-6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Standard InChI: InChI=1S/C22H22O11/c1-30-21-14(32-22-20(29)19(28)17(26)15(8-23)33-22)7-13-16(18(21)27)11(25)6-12(31-13)9-2-4-10(24)5-3-9/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3/t15-,17-,19+,20-,22-/m1/s1
Standard InChI Key: GCLAFEGUXXHIFT-IWLDQSELSA-N
SMILES: OC[C@H]1O[C@@H](Oc2cc3oc(cc(=O)c3c(c2OC)O)c2ccc(cc2)O)[C@@H]([C@H]([C@@H]1O)O)O

Molecular propeties

AlogP: 0.06
Hydrogen bonds acceptors: 11
Hydrogen bonds donors: 6
Rotatable bonds: 5
Number of rings: 4
Molecular Weight: 462.12
Topological polar surface area: 175
Number of aromatic rings: 3
Fsp3: 0.318
Number of carbons: 22

Plant sources

Part of plant Plant name Ref.
PlantPlantago major

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.