Phyto4Health

6''-O-Acetylhyperoside

Representations & DB's id

ChEBI: None
ChEMBL: CHEMBL559041
PubChem: 25230434
IUPAC: [(2R,3R,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl acetate
Standard InChI: InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17+,19+,20-,23+/m1/s1
Standard InChI Key: IGLUNMMNDNWZOA-QZGPLKIZSA-N
SMILES: CC(=O)OC[C@H]1O[C@@H](Oc2c(oc3c(c2=O)c(O)cc(c3)O)c2ccc(c(c2)O)O)[C@@H]([C@H]([C@H]1O)O)O

Molecular propeties

AlogP: 0.03
Hydrogen bonds acceptors: 13
Hydrogen bonds donors: 7
Rotatable bonds: 5
Number of rings: 4
Molecular Weight: 506.11
Topological polar surface area: 213
Number of aromatic rings: 3
Fsp3: 0.304
Number of carbons: 23

Plant sources

Part of plant Plant name Ref.
PlantRhododendron tomentosum

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.