CHEBI:63596 - 5-[(1-phenylcyclohexyl)amino]pentanoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-[(1-phenylcyclohexyl)amino]pentanoic acid
ChEBI ID CHEBI:63596
Definition A fatty acid derivative consisting of valeric acid substituted at C-5 with an N-(1-phenylcyclohexyl)amino group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C17H25NO2
Net Charge 0
Average Mass 275.38590
Monoisotopic Mass 275.18853
InChI InChI=1S/C17H25NO2/c19-16(20)11-5-8-14-18-17(12-6-2-7-13-17)15-9-3-1-4-10-15/h1,3-4,9-10,18H,2,5-8,11-14H2,(H,19,20)
InChIKey RZGZMLICFFEUIQ-UHFFFAOYSA-N
SMILES OC(=O)CCCCNC1(CCCCC1)c1ccccc1
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 5-[(1-phenylcyclohexyl)amino]pentanoic acid (CHEBI:63596) has functional parent valeric acid (CHEBI:17418)
5-[(1-phenylcyclohexyl)amino]pentanoic acid (CHEBI:63596) has role metabolite (CHEBI:25212)
5-[(1-phenylcyclohexyl)amino]pentanoic acid (CHEBI:63596) is a fatty acid derivative (CHEBI:61697)
5-[(1-phenylcyclohexyl)amino]pentanoic acid (CHEBI:63596) is a secondary amino compound (CHEBI:50995)
IUPAC Name
5-[(1-phenylcyclohexyl)amino]pentanoic acid
Synonyms Sources
5-(1-Phenylcyclohexylamino)valeric acid ChemIDplus
5-[N-(1'-phenylcyclohexyl)amino]pentanoic acid ChEBI
5-Pchap ChemIDplus
PCHP ChEBI
Registry Numbers Types Sources
5282428 Reaxys Registry Number Reaxys
77160-83-9 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
8371148 PubMed citation Europe PMC
Last Modified
18 January 2012