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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
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.
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Molfile
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 (Br
o
nsted base).
(via
oxoacid
)
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
View more via ChEBI Ontology
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
View more database links
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