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> Main
CHEBI:138669 -
N
-methyl-β-alanine
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ChEBI Name
N
-methyl-β-alanine
ChEBI ID
CHEBI:138669
ChEBI ASCII Name
N-methyl-beta-alanine
Definition
A β-amino acid that is propionic acid in which one of the hydrogens at position 3 has been replaced by a methylamino group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C4H9NO2
Net Charge
0
Average Mass
103.120
Monoisotopic Mass
103.06333
InChI
InChI=1S/C4H9NO2/c1-5-3-2-4(6)7/h5H,2-3H2,1H3,(H,6,7)
InChIKey
VDIPNVCWMXZNFY-UHFFFAOYSA-N
SMILES
C(CCNC)(=O)O
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
N
-methyl-β-alanine (
CHEBI:138669
)
has functional parent
β-alanine (
CHEBI:16958
)
N
-methyl-β-alanine (
CHEBI:138669
)
is a
β-amino acid (
CHEBI:33706
)
N
-methyl-β-alanine (
CHEBI:138669
)
is a
secondary amino compound (
CHEBI:50995
)
Incoming
N
,
N
-dimethyl-β-alanine (
CHEBI:138668
)
has functional parent
N
-methyl-β-alanine (
CHEBI:138669
)
IUPAC Name
N
-methyl-β-alanine
Synonyms
Sources
3-(methylamino)propanoic acid
IUPAC
3-(methylamino)propionic acid
IUPAC
3-methylaminopropanoic acid
ChEBI
3-methylaminopropionic acid
ChEBI
Manual Xref
Database
CPD-6141
MetaCyc
View more database links
Registry Numbers
Types
Sources
2679-14-3
CAS Registry Number
ChemIDplus
773862
Reaxys Registry Number
Reaxys
Citation
Type
Source
16591973
PubMed citation
Europe PMC
Last Modified
12 October 2017