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CHEBI:191250 - Lifibrol

ChEBI IDCHEBI:191250
ChEBI NameLifibrol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H26O4
Net Charge0
Average Mass342.435
Monoisotopic Mass342.18311
SMILESCC(C)(C)c1ccc(CCC(O)COc2ccc(C(=O)O)cc2)cc1
InChIInChI=1S/C21H26O4/c1-21(2,3)17-9-4-15(5-10-17)6-11-18(22)14-25-19-12-7-16(8-13-19)20(23)24/h4-5,7-10,12-13,18,22H,6,11,14H2,1-3H3,(H,23,24)
InChIKeyLNXBEIZREVRNTF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) hTERT-RPE1 cell (BTO:0004790) MetaboLights (MTBLS682)
ChEBI Ontology
Outgoing Relation(s)
Lifibrol (CHEBI:191250) is a alkylbenzene (CHEBI:38976)
IUPAC Name 
4-[4-(4-tert-butylphenyl)-2-hydroxybutoxy]benzoic acid
Manual XrefsDatabases
51499ChemSpider
D04737KEGG DRUG
DB12448DrugBank
Registry NumbersSources
CAS:96609-16-4ChemIDplus