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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:41139 -
N
,
N
,
N
-trimethylglycinium
Main
ChEBI Ontology
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ChEBI Name
N
,
N
,
N
-trimethylglycinium
ChEBI ID
CHEBI:41139
ChEBI ASCII Name
N,N,N-trimethylglycinium
Definition
A quaternary ammonium ion in which the substituents on nitrogen are methyl (three) and carboxymethyl.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:41134, CHEBI:12531
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Formula
C5H12NO2
Net Charge
+1
Average Mass
118.154
Monoisotopic Mass
118.08626
InChI
InChI=1S/C5H11NO2/c1-6(2,3)4-5(7)8/h4H2,1-3H3/p+1
InChIKey
KWIUHFFTVRNATP-UHFFFAOYSA-O
SMILES
[N+](C)(C)(C)CC(=O)O
Roles Classification
Biological Role
(s):
fundamental metabolite
Any metabolite produced by all living cells.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
N
,
N
,
N
-trimethylglycinium (
CHEBI:41139
)
has role
fundamental metabolite (
CHEBI:78675
)
N
,
N
,
N
-trimethylglycinium (
CHEBI:41139
)
is a
quaternary ammonium ion (
CHEBI:35267
)
N
,
N
,
N
-trimethylglycinium (
CHEBI:41139
)
is conjugate acid of
glycine betaine (
CHEBI:17750
)
Incoming
glycine betaine hydrate (
CHEBI:91242
)
has part
N
,
N
,
N
-trimethylglycinium (
CHEBI:41139
)
glycine betaine (
CHEBI:17750
)
is conjugate base of
N
,
N
,
N
-trimethylglycinium (
CHEBI:41139
)
IUPAC Name
carboxy-
N
,
N
,
N
-trimethylmethanaminium
Synonym
Source
TRIMETHYL GLYCINE
PDBeChem
Manual Xrefs
Databases
BET
PDBeChem
DB04455
DrugBank
ECMDB04024
ECMDB
View more database links
Registry Numbers
Types
Sources
1758492
Beilstein Registry Number
Beilstein
1758492
Reaxys Registry Number
Reaxys
324712
Gmelin Registry Number
Gmelin
Last Modified
17 February 2016