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desmethylxanthohumol

Properties

Image

Occurences in reactions

MNX_ID

MNXM5716

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

formula

C₂₀H₁₉O₅

charge

-1

mass

339.1238

reference

InChIKey

FUSADYLVRMROPL-UXBLZVDNSA-M

InChI

InChI=1S/C20H20O5/c1-12(2)3-9-15-17(23)11-18(24)19(20(15)25)16(22)10-6-13-4-7-14(21)8-5-13/h3-8,10-11,21,23-25H,9H2,1-2H3/p-1/b10-6+

SMILES

CC(C)=CCc1c(O)cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c1[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:134302 chebi:134302	desmethylxanthohumol 3,5-dihydroxy-2-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-(3-methylbut-2-en-1-yl)phenolate desmethylxanthohumol(1-)
kegg.compound:C16416 keggC:C16416	Desmethylxanthohumol
hmdb:HMDB0030610	Desmethylxanthohumol (2E)-3-(4-hydroxyphenyl)-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]prop-2-en-1-one 1-(2,4-Dihydroxy-6-methoxy-3-(3-methyl-2-butenyl)phenyl)-3-(4-hydroxyphenyl)-2-propen-1-one 3-(4-Hydroxyphenyl)-1-[2,4,6-trihydroxy-3-(3-methyl-2-butenyl)phenyl]-2-propen-1-one Xanthohumol desmethylxanthohumol
seed.compound:cpd15122 seedM:cpd15122	Desmethylxanthohumol (2E)-3-(4-hydroxyphenyl)-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]prop-2-en-1-one 2',4,4',6'-tetrahydroxy-3-prenylchalcone desmethylxanthohumol
CHEBI:80489 chebi:80489	desmethylxanthohumol (2E)-3-(4-hydroxyphenyl)-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]prop-2-en-1-one
metacyc.compound:CPD-7120 metacycM:CPD-7120	desmethylxanthohumol (2E)-3-(4-hydroxyphenyl)-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]prop-2-en-1-one 2',4,4',6'-tetrahydroxy-3-prenylchalcone
hmdb:HMDB30610 keggC:M_C16416 seedM:M_cpd15122	secondary/obsolete/fantasy identifier