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CHEBI:139593 - 4-O-methylxanthohumol

ChEBI IDCHEBI:139593
ChEBI Name4-O-methylxanthohumol
Stars
ASCII Name4-O-methylxanthohumol
DefinitionA member of the class of chalcones that is trans-chalcone substituted by hydroxy groups at positions 2' and 4', methoxy group at positions 4 and 6' and a prenyl group at position 3'.
Last Modified15 May 2024
SubmitterSteve
DownloadsMolfile
FormulaC22H24O5
Net Charge0
Average Mass368.429
Monoisotopic Mass368.16237
SMILESCOc1ccc(/C=C/C(=O)c2c(OC)cc(O)c(CC=C(C)C)c2O)cc1
InChIInChI=1S/C22H24O5/c1-14(2)5-11-17-19(24)13-20(27-4)21(22(17)25)18(23)12-8-15-6-9-16(26-3)10-7-15/h5-10,12-13,24-25H,11H2,1-4H3/b12-8+
InChIKeyHOOCUUOYPZNVKX-XYOKQWHBSA-N
ChEBI Ontology
Outgoing Relation(s)
4-O-methylxanthohumol (CHEBI:139593) has functional parent trans-chalcone (CHEBI:48965)
4-O-methylxanthohumol (CHEBI:139593) is a aromatic ether (CHEBI:35618)
4-O-methylxanthohumol (CHEBI:139593) is a chalcones (CHEBI:23086)
4-O-methylxanthohumol (CHEBI:139593) is a resorcinols (CHEBI:33572)
4-O-methylxanthohumol (CHEBI:139593) is conjugate acid of 4-O-methylxanthohumol(1−) (CHEBI:139273)
Incoming Relation(s)
4-O-methylxanthohumol(1−) (CHEBI:139273) is conjugate base of 4-O-methylxanthohumol (CHEBI:139593)
IUPAC Name 
(2E)-1-[2,4-dihydroxy-6-methoxy-3-(3-methylbut-2-en-1-yl)phenyl]-3-(4-methoxyphenyl)prop-2-en-1-one
UniProt Name  Source
4-O-methylxanthohumolUniProt
Registry NumbersSources
Reaxys:10479895Reaxys
Citations