CHEBI:16758 - 3-dehydrocarnitinium

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ChEBI Name 3-dehydrocarnitinium
ChEBI ID CHEBI:16758
Definition A quaternary ammonium ion that is the conjugate acid of 3-dehydrocarnitine.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:11779, CHEBI:1485, CHEBI:19995
Supplier Information
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Formula C7H14NO3
Net Charge +1
Average Mass 160.19100
Monoisotopic Mass 160.09682
InChI InChI=1S/C7H13NO3/c1-8(2,3)5-6(9)4-7(10)11/h4-5H2,1-3H3/p+1
InChIKey YNOWULSFLVIUDH-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).
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ChEBI Ontology
Outgoing 3-dehydrocarnitinium (CHEBI:16758) has functional parent carnitinium (CHEBI:3424)
3-dehydrocarnitinium (CHEBI:16758) has role human metabolite (CHEBI:77746)
3-dehydrocarnitinium (CHEBI:16758) is a quaternary ammonium ion (CHEBI:35267)
3-dehydrocarnitinium (CHEBI:16758) is conjugate acid of 3-dehydrocarnitine (CHEBI:57885)
Incoming 3-dehydrocarnitine (CHEBI:57885) is conjugate base of 3-dehydrocarnitinium (CHEBI:16758)
IUPAC Name
3-carboxy-N,N,N-trimethyl-2-oxopropan-1-aminium
Synonyms Sources
3-carboxy-N,N,N-trimethyl-2-oxo-1-propanaminium ChEBI
3-Carboxy-N,N,N-trimethyl-2-oxo-1-propanaminium KEGG COMPOUND
3-Dehydrocarnitine KEGG COMPOUND
Manual Xref Database
C02636 KEGG COMPOUND
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Registry Number Type Source
10457-99-5 CAS Registry Number KEGG COMPOUND
Last Modified
18 September 2014