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Chemical structure of Desmethylxanthohumol

GC62927

Desmethylxanthohumol

Also known as (E)-3-(4-hydroxyphenyl)-1-[2,4,6-trihydroxy-3-(3-methylbut-2-enyl)phenyl]prop-2-en-1-one

Desmethylxanthohumol is a prenylated hydroxychalcone isolated from hop cones (Humulus lupulus L·)· Desmethylxanthohumol is a powerful apoptosis inducing agent· Desmethylxanthohumol has antiplasmodial, antiproliferative, and antioxidant bioactivities

ChemicalCAS115063-39-3MW340.37FormulaC20H20O5
CAS number
115063-39-3
Molecular weight
340.37
Formula
C20H20O5
InChIKey
FUSADYLVRMROPL-UXBLZVDNSA-N
Catalogue number
GC62927
Brand
GLPBIO
Computed properties PubChem CID 6443339 · XLogP 4.7 · TPSA 98 Ų · H-bond donors 4
XLogP
4.7
TPSA
98 Ų
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
25

SMILES CC(=CCC1=C(C(=C(C=C1O)O)C(=O)/C=C/C2=CC=C(C=C2)O)O)C

Computed descriptors from PubChem (CID 6443339), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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