CHEBI:132187 - N-ethyldiethanolamine

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ChEBI Name N-ethyldiethanolamine ChEBI ID CHEBI:132187 ChEBI ASCII Name N-ethyldiethanolamine Definition A aminodiol that is diethanolamine in which the amino hydrogen has been replaced by an ethyl group. It is a metabolite of nitrogen mustards. 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 C6H15NO2 Net Charge 0 Average Mass 133.189 Monoisotopic Mass 133.11028 InChI InChI=1S/C6H15NO2/c1-2-7(3-5-8)4-6-9/h8-9H,2-6H2,1H3 InChIKey AKNUHUCEWALCOI-UHFFFAOYSA-N SMILES CCN(CCO)CCO Metabolite of Species Details Rattus norvegicus (NCBI:txid10116) Found in urine (BTO:0001419). See: PubMed Pseudomonas putida DOT-T1E (NCBI:txid1196325) See: MetaboLights Study Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: PubMed Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Biological Role(s): human urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples. human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. rat metabolite Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus). View more via ChEBI Ontology ChEBI Ontology Outgoing N-ethyldiethanolamine (CHEBI:132187) has functional parent ethanolamine (CHEBI:16000) N-ethyldiethanolamine (CHEBI:132187) has role human urinary metabolite (CHEBI:84087) N-ethyldiethanolamine (CHEBI:132187) has role human xenobiotic metabolite (CHEBI:76967) N-ethyldiethanolamine (CHEBI:132187) has role rat metabolite (CHEBI:86264) N-ethyldiethanolamine (CHEBI:132187) is a aminodiol (CHEBI:22501) N-ethyldiethanolamine (CHEBI:132187) is a primary alcohol (CHEBI:15734) N-ethyldiethanolamine (CHEBI:132187) is a tertiary amino compound (CHEBI:50996) IUPAC Name 2,2'-(ethylazanediyl)di(ethan-1-ol) Synonyms Sources 2,2'-(Ethylazanediyl)diethanol NIST Chemistry WebBook 2,2'-(Ethylimino)bisethanol ChemIDplus 2,2'-(ethylimino)diethanol ChEBI 2-(N-Ethyl-N-2-hydroxyethylamino)ethanol ChemIDplus Diethanolethylamine ChemIDplus Ethyl diethanolamine ChemIDplus Ethylbis(2-hydroxyethyl)amine ChemIDplus Ethyldiethanolamine ChemIDplus N,N-Bis(2-hydroxyethyl)ethylamine NIST Chemistry WebBook N-Bis(2-hydroxyethyl)-N-ethylamine NIST Chemistry WebBook N-Ethyl-2,2'-iminodiethanol ChemIDplus Manual Xref Database 8439 ChemSpider View more database links Registry Numbers Types Sources 139-87-7 CAS Registry Number NIST Chemistry WebBook 139-87-7 CAS Registry Number ChemIDplus 1735791 Reaxys Registry Number Reaxys 1735791 Beilstein Registry Number ChemIDplus Citations Types Sources 11180637 PubMed citation Europe PMC 12587675 PubMed citation Europe PMC 15239850 PubMed citation Europe PMC 16310795 PubMed citation Europe PMC 16707130 PubMed citation Europe PMC 19796767 PubMed citation Europe PMC 21737081 PubMed citation Europe PMC 21764395 PubMed citation Europe PMC 23218189 PubMed citation Europe PMC Last Modified 07 December 2016