CHEBI:15724 - trimethylamine N-oxide

ChEBI IDCHEBI:15724
ChEBI Nametrimethylamine N-oxide
Stars
ASCII Nametrimethylamine N-oxide
DefinitionA tertiary amine oxide resulting from the oxidation of the amino group of trimethylamine.
Secondary ChEBI IDsCHEBI:9733, CHEBI:15262, CHEBI:15263, CHEBI:27126
Last Modified16 November 2020
DownloadsMolfile
FormulaC3H9NO
Net Charge0
Average Mass75.111
Monoisotopic Mass75.06841
SMILESC[N+](C)(C)[O-]
InChIInChI=1S/C3H9NO/c1-4(2,3)5/h1-3H3
InChIKeyUYPYRKYUKCHHIB-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Roles Classification
Biological Roles:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
osmolyte  A solute used by a cell under water stress to maintain cell volume.
ChEBI Ontology
Outgoing Relation(s)
trimethylamine N-oxide (CHEBI:15724) has functional parent trimethylamine (CHEBI:18139)
trimethylamine N-oxide (CHEBI:15724) has role Escherichia coli metabolite (CHEBI:76971)
trimethylamine N-oxide (CHEBI:15724) has role metabolite (CHEBI:25212)
trimethylamine N-oxide (CHEBI:15724) has role osmolyte (CHEBI:25728)
trimethylamine N-oxide (CHEBI:15724) is a tertiary amine oxide (CHEBI:134363)
trimethylamine N-oxide (CHEBI:15724) is conjugate base of hydroxytrimethylaminium (CHEBI:166856)
Incoming Relation(s)
hydroxytrimethylaminium (CHEBI:166856) is conjugate acid of trimethylamine N-oxide (CHEBI:15724)
IUPAC Name 
N,N-dimethylmethanamine oxide
Synonyms  Source
(CH3)3NOIUPAC
Me3N(+)O(-)ChEBI
Me3N(O)ChEBI
N(CH3)3OChEBI
TMAONIST Chemistry WebBook
Trimethylamine N-oxideKEGG COMPOUND
UniProt Name  Source
trimethylamine N-oxideUniProt
Manual XrefsDatabases
C01104KEGG COMPOUND
HMDB0000925HMDB
TMOPDBeChem
TRIMENTHLAMINE-N-OMetaCyc
Trimethylamine_oxideWikipedia
Registry NumbersSources
Reaxys:1734787Reaxys
Gmelin:1839Gmelin
CAS:1184-78-7KEGG COMPOUND
CAS:1184-78-7ChemIDplus
CAS:1184-78-7NIST Chemistry WebBook
Citations