CHEBI:1941 - 4-(trimethylammonio)butanoic acid

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ChEBI Name 4-(trimethylammonio)butanoic acid ChEBI ID CHEBI:1941 Definition A quaternary ammonium ion that is the conjugate acid of 4-(trimethylammonio)butanoate. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C7H16NO2 Net Charge +1 Average Mass 146.20748 Monoisotopic Mass 146.11756 InChI InChI=1S/C7H15NO2/c1-8(2,3)6-4-5-7(9)10/h4-6H2,1-3H3/p+1 InChIKey JHPNVNIEXXLNTR-UHFFFAOYSA-O SMILES C[N+](C)(C)CCCC(O)=O Metabolite of Species Details Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed Escherichia coli (NCBI:txid562) See: PubMed Roles Classification Biological Role(s): Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. 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 4-(trimethylammonio)butanoic acid (CHEBI:1941) has role Escherichia coli metabolite (CHEBI:76971) 4-(trimethylammonio)butanoic acid (CHEBI:1941) has role human metabolite (CHEBI:77746) 4-(trimethylammonio)butanoic acid (CHEBI:1941) has role mouse metabolite (CHEBI:75771) 4-(trimethylammonio)butanoic acid (CHEBI:1941) is a quaternary ammonium ion (CHEBI:35267) 4-(trimethylammonio)butanoic acid (CHEBI:1941) is conjugate acid of 4-(trimethylammonio)butanoate (CHEBI:16244) Incoming γ-butyrobetainyl-CoA (CHEBI:61517) has functional parent 4-(trimethylammonio)butanoic acid (CHEBI:1941) carpronium (CHEBI:145653) has functional parent 4-(trimethylammonio)butanoic acid (CHEBI:1941) 4-(trimethylammonio)butanoate (CHEBI:16244) is conjugate base of 4-(trimethylammonio)butanoic acid (CHEBI:1941) IUPAC Name 3-carboxy-N,N,N-trimethylpropan-1-aminium Synonyms Sources 4-Trimethylammoniobutanoate KEGG COMPOUND Butyrobetaine HMDB gamma-Butyrobetaine HMDB γ-butyrobetaine ChEBI Manual Xrefs Databases C01181 KEGG COMPOUND HMDB0001161 HMDB NM2 PDBeChem View more database links Registry Number Type Source 1765273 Reaxys Registry Number Reaxys Last Modified 09 December 2019