CHEBI:18139 - trimethylamine

ChEBI IDCHEBI:18139
ChEBI Nametrimethylamine
Stars
DefinitionA tertiary amine that is ammonia in which each hydrogen atom is substituted by an methyl group.
Secondary ChEBI IDsCHEBI:9732, CHEBI:15261, CHEBI:27125, CHEBI:27127
Last Modified25 January 2016
DownloadsMolfile
FormulaC3H9N
Net Charge0
Average Mass59.112
Monoisotopic Mass59.07350
SMILESCN(C)C
InChIInChI=1S/C3H9N/c1-4(2)3/h1-3H3
InChIKeyGETQZCLCWQTVFV-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
trimethylamine (CHEBI:18139) has role Escherichia coli metabolite (CHEBI:76971)
trimethylamine (CHEBI:18139) has role human xenobiotic metabolite (CHEBI:76967)
trimethylamine (CHEBI:18139) is a methylamines (CHEBI:25274)
trimethylamine (CHEBI:18139) is a tertiary amine (CHEBI:32876)
trimethylamine (CHEBI:18139) is conjugate base of trimethylammonium (CHEBI:58389)
Incoming Relation(s)
trimethylamine N-oxide (CHEBI:15724) has functional parent trimethylamine (CHEBI:18139)
trimethylammonium (CHEBI:58389) is conjugate acid of trimethylamine (CHEBI:18139)
IUPAC Name 
N,N-dimethylmethanamine
Synonyms  Source
(CH3)3NKEGG COMPOUND
N,N,N-trimethylamineChEBI
N(CH3)3ChEBI
NMe3ChEBI
N,N-DimethylmethanamineKEGG COMPOUND
TMANIST Chemistry WebBook
Manual XrefsDatabases
C00001433KNApSAcK
C00565KEGG COMPOUND
HMDB0000906HMDB
KENPDBeChem
TrimethylamineWikipedia
TRIMETHYLAMINEMetaCyc
Registry NumbersSources
Gmelin:1309Gmelin
Reaxys:956566Reaxys
CAS:75-50-3KEGG COMPOUND
CAS:75-50-3ChemIDplus
CAS:75-50-3NIST Chemistry WebBook
Citations