Description
IUPAC Name: (E)-1-[2,4-dihydroxy-3-(2-hydroxy-3-methylbut-3-enyl)-6-methoxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one
InChI: InChI=1S/C21H22O6/c1-12(2)17(24)10-15-18(25)11-19(27-3)20(21(15)26)16(23)9-6-13-4-7-14(22)8-5-13/h4-9,11,17,22,24-26H,1,10H2,2-3H3/b9-6+
InChIKey: IIWLGOCXDBSFCM-RMKNXTFCSA-N
Canonical SMILES: CC(=C)C(CC1=C(C(=C(C=C1O)OC)C(=O)C=CC2=CC=C(C=C2)O)O)O
Isomeric SMILES: CC(=C)C(CC1=C(C(=C(C=C1O)OC)C(=O)/C=C/C2=CC=C(C=C2)O)O)O
Synonyms: Xanthohumol D; 274675-25-1; CHEBI:66335; 3′-(2-Hydroxy-3-methylbutyl-3-enyl)-4,2′,4′-trihydroxy-6′-methoxychalcone; (E)-1-[2,4-dihydroxy-3-(2-hydroxy-3-methylbut-3-enyl)-6-methoxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one; XanthohumolD; CHEMBL479500; SCHEMBL12961708; …
Botanical Source: Humulus lupulus Linn.