Phyto4Health

Torachrysone 8-O-Glucoside

Representations & DB's id

ChEBI: None
ChEMBL: CHEMBL109330
PubChem: 11972479
IUPAC: 1-[1-hydroxy-6-methoxy-3-methyl-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalen-2-yl]ethanone
Standard InChI: InChI=1S/C20H24O9/c1-8-4-10-5-11(27-3)6-12(15(10)17(24)14(8)9(2)22)28-20-19(26)18(25)16(23)13(7-21)29-20/h4-6,13,16,18-21,23-26H,7H2,1-3H3/t13-,16-,18+,19-,20-/m1/s1
Standard InChI Key: GHKWPHRULCFTBB-CZNQJBLBSA-N
SMILES: OC[C@H]1O[C@@H](Oc2cc(OC)cc3c2c(O)c(c(c3)C)C(=O)C)[C@@H]([C@H]([C@@H]1O)O)O

Molecular propeties

AlogP: 0.24
Hydrogen bonds acceptors: 9
Hydrogen bonds donors: 5
Rotatable bonds: 5
Number of rings: 3
Molecular Weight: 408.14
Topological polar surface area: 146
Number of aromatic rings: 2
Fsp3: 0.45
Number of carbons: 20

Plant sources

Part of plant Plant name Ref.
PlantVerbascum thapsiforme
PlantLavandula vera
PlantTanacetum coccineum
RhizomaRheum palmatum
PlantGlycyrrhiza uralensis

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.