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1-(4'-hydroxy-3'-methoxyphenyl)-7-phenyl-3-heptanone

PropertiesImage
MNX_IDMNXM101229 Image of MNXM101229
referencechebi:66033
formulaC20H24O3
global charge0
mol weight312.409
InChIKeyTXELARZTKDBEKS-UHFFFAOYSA-N
InChIInChI=1S/C20H24O3/c1-23-20-15-17(12-14-19(20)22)11-13-18(21)10-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,12,14-15,22H,5-6,9-11,13H2,1H3
SMILESCOC1=CC(CCC(=O)CCCCC2=CC=CC=C2)=CC=C1O
MNX internals
InChI (mnx)InChI=1/C20H24O3/c1-23-20-15-17(12-14-19(20)22)11-13-18(21)10-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,12,14-15,22H,5-6,9-11,13H2,1H3 Image of MNXM101229
SMILES (mnx)[CH3:1][O:23][C:20]1=[C:19]([OH:22])[CH:14]=[CH:12][C:17]([CH2:11][CH2:13][C:18]([CH2:10][CH2:6][CH2:5][CH2:9][C:16]2=[CH:7][CH:3]=[CH:2][CH:4]=[CH:8]2)=[O:21])=[CH:15]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:66033
chebi:66033
TXELARZTKDBEKS-UHFFFAOYSA-N 		1-(4'-hydroxy-3'-methoxyphenyl)-7-phenyl-3-heptanone
1-(4-hydroxy-3-methoxyphenyl)-7-phenylheptan-3-one
Yakuchinone-A

seed.compound:cpd21444
seedM:cpd21444
kegg.compound:C20211
keggC:C20211
TXELARZTKDBEKS-UHFFFAOYSA-N 		Yakuchinone A
Yakuchinone-A
hmdb:HMDB0259946
TXELARZTKDBEKS-UHFFFAOYSA-N 		Yakuchinone-A
1-(4'-Hydroxy-3'-methoxyphenyl)-7-phenyl-3-heptanone
1-(4-hydroxy-3-methoxyphenyl)-7-phenylheptan-3-one
Yakuchinone-a

keggC:M_C20211
seedM:M_cpd21444 		secondary/obsolete/fantasy identifier