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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:77042 -
N
,
N
-dimethyl-
L
-alanine
Main
ChEBI Ontology
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ChEBI Name
N
,
N
-dimethyl-
L
-alanine
ChEBI ID
CHEBI:77042
ChEBI ASCII Name
N,N-dimethyl-L-alanine
Definition
A methyl-
L
-alanine in which both the amino hydrogens of
L
-alanine are replaced by methyl groups.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:43658
Supplier Information
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Molfile
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Molfile
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Formula
C5H11NO2
Net Charge
0
Average Mass
117.14630
Monoisotopic Mass
117.07898
InChI
InChI=1S/C5H11NO2/c1-4(5(7)8)6(2)3/h4H,1-3H3,(H,7,8)/t4-/m0/s1
InChIKey
QCYOIFVBYZNUNW-BYPYZUCNSA-N
SMILES
C[C@H](N(C)C)C(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
,
N
-dimethyl-
L
-alanine (
CHEBI:77042
)
is a
methyl-
L
-alanine (
CHEBI:25264
)
Incoming
N
,
N
-dimethyl-
L
-alanyl group (
CHEBI:77037
)
is substituent group from
N
,
N
-dimethyl-
L
-alanine (
CHEBI:77042
)
IUPAC Name
N
,
N
-dimethyl-
L
-alanine
Synonyms
Sources
(2
S
)-2-(dimethylamino)propanoic acid
ChEBI
N(alpha),N(alpha)-Dimethylalanine
ChemIDplus
N
,
N
-dimethylalanine
ChEBI
Manual Xrefs
Databases
DB02167
DrugBank
LAL
PDBeChem
View more database links
Registry Numbers
Types
Sources
2323116
Reaxys Registry Number
Reaxys
2812-31-9
CAS Registry Number
ChemIDplus
Last Modified
21 January 2014