CHEBI:116931 - nipecotic acid

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ChEBI Name nipecotic acid
ChEBI ID CHEBI:116931
Definition A piperidinemonocarboxylic acid that is piperidine in which one of the hydrogens at position 3 is substituted by a carboxylic acid group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C6H11NO2
Net Charge 0
Average Mass 129.15700
Monoisotopic Mass 129.07898
InChI InChI=1S/C6H11NO2/c8-6(9)5-2-1-3-7-4-5/h5,7H,1-4H2,(H,8,9)
InChIKey XJLSEXAGTJCILF-UHFFFAOYSA-N
SMILES OC(=O)C1CCCNC1
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing nipecotic acid (CHEBI:116931) is a β-amino acid (CHEBI:33706)
nipecotic acid (CHEBI:116931) is a piperidinemonocarboxylic acid (CHEBI:26148)
Incoming (R)-nipecotic acid (CHEBI:221278) is a nipecotic acid (CHEBI:116931)
(S)-nipecotic acid (CHEBI:222169) is a nipecotic acid (CHEBI:116931)
IUPAC Name
piperidine-3-carboxylic acid
Synonyms Sources
3-piperidinecarboxylic acid ChEBI
hexahydronicotinic acid ChEBI
Piperidine-3-carboxylic acid ChEMBL
Manual Xrefs Databases
LSM-6517 LINCS
US3159639 Patent
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Registry Numbers Types Sources
1782986 Gmelin Registry Number Gmelin
498-95-3 CAS Registry Number ChemIDplus
81096 Beilstein Registry Number Beilstein
Last Modified
25 February 2016