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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:3424 - carnitinium
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ChEBI Ontology
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ChEBI Name
carnitinium
ChEBI ID
CHEBI:3424
Definition
A quaternary ammonium ion that is the the conjugate acid of carnitine.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C7H16NO3
Net Charge
+1
Average Mass
162.20688
Monoisotopic Mass
162.11247
InChI
InChI=1S/C7H15NO3/c1-8(2,3)5-6(9)4-7(10)11/h6,9H,4-5H2,1-3H3/p+1
InChIKey
PHIQHXFUZVPYII-UHFFFAOYSA-O
SMILES
C[N+](C)(C)CC(O)CC(O)=O
Roles Classification
Biological Role
(s):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
carnitinium (
CHEBI:3424
)
has functional parent
γ-amino-β-hydroxybutyric acid (
CHEBI:16080
)
carnitinium (
CHEBI:3424
)
has role
human metabolite (
CHEBI:77746
)
carnitinium (
CHEBI:3424
)
has role
mouse metabolite (
CHEBI:75771
)
carnitinium (
CHEBI:3424
)
is a
quaternary ammonium ion (
CHEBI:35267
)
carnitinium (
CHEBI:3424
)
is conjugate acid of
carnitine (
CHEBI:17126
)
Incoming
3-dehydrocarnitinium (
CHEBI:16758
)
has functional parent
carnitinium (
CHEBI:3424
)
(
R
)-carnitinium (
CHEBI:39547
)
is a
carnitinium (
CHEBI:3424
)
(
S
)-carnitinium (
CHEBI:51453
)
is a
carnitinium (
CHEBI:3424
)
carnitine (
CHEBI:17126
)
is conjugate base of
carnitinium (
CHEBI:3424
)
IUPAC Name
3-carboxy-2-hydroxy-
N
,
N
,
N
-trimethylpropan-1-aminium
Synonyms
Sources
3-hydroxy-4-(trimethylammonio)butanoic acid
ChEBI
Carnitine
KEGG COMPOUND
Manual Xref
Database
C00487
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
406-76-8
CAS Registry Number
KEGG COMPOUND
461-06-3
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014