4-(4-hydroxyphenyl)-4-methyl-2-pentanone (CHEBI:188946)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:188946 - 4-(4-hydroxyphenyl)-4-methyl-2-pentanone

Take structure to advanced search

ChEBI ID	CHEBI:188946
ChEBI Name	4-(4-hydroxyphenyl)-4-methyl-2-pentanone
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C12H16O2
Net Charge	0
Average Mass	192.258
Monoisotopic Mass	192.11503
SMILES	CC(=O)CC(C)(C)c1ccc(O)cc1
InChI	InChI=1S/C12H16O2/c1-9(13)8-12(2,3)10-4-6-11(14)7-5-10/h4-7,14H,8H2,1-3H3
InChIKey	KJUFIUUAJYKALT-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Staphylococcus Aureus (ncbitaxon:1280)	Whole Organism (NCIT:C13413)	MetaboLights (MTBLS3859)

ChEBI Ontology

Outgoing Relation(s)
	4-(4-hydroxyphenyl)-4-methyl-2-pentanone (CHEBI:188946) is a alkylbenzene (CHEBI:38976)

IUPAC Name
4-(4-hydroxyphenyl)-4-methylpentan-2-one

Manual Xrefs	Databases
508095	ChemSpider