CHEBI:28621 - triethanolamine

ChEBI IDCHEBI:28621
ChEBI Nametriethanolamine
Stars
DefinitionA tertiary amino compound that is ammonia in which each of the hydrogens is substituted by a 2-hydroxyethyl group.
Secondary ChEBI IDsCHEBI:9707, CHEBI:27108, CHEBI:39717
Last Modified22 February 2017
DownloadsMolfile
FormulaC6H15NO3
Net Charge0
Average Mass149.190
Monoisotopic Mass149.10519
SMILESOCCN(CCO)CCO
InChIInChI=1S/C6H15NO3/c8-4-1-7(2-5-9)3-6-10/h8-10H,1-6H2
InChIKeyGSEJCLTVZPLZKY-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Roles:
surfactant  A substance which lowers the surface tension of the medium in which it is dissolved, and/or the interfacial tension with other phases, and, accordingly, is positively adsorbed at the liquid/vapour and/or at other interfaces.
buffer  Any substance or mixture of substances that, in solution (typically aqueous), resists change in pH upon addition of small amounts of acid or base.
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Application:
anti-ulcer drug  One of various classes of drugs with different action mechanisms used to treat or ameliorate peptic ulcer or irritation of the gastrointestinal tract.
ChEBI Ontology
Outgoing Relation(s)
triethanolamine (CHEBI:28621) has functional parent triethylamine (CHEBI:35026)
triethanolamine (CHEBI:28621) has role anti-ulcer drug (CHEBI:49201)
triethanolamine (CHEBI:28621) has role buffer (CHEBI:35225)
triethanolamine (CHEBI:28621) has role surfactant (CHEBI:35195)
triethanolamine (CHEBI:28621) is a amino alcohol (CHEBI:22478)
triethanolamine (CHEBI:28621) is a tertiary amino compound (CHEBI:50996)
triethanolamine (CHEBI:28621) is a triol (CHEBI:27136)
triethanolamine (CHEBI:28621) is conjugate base of triethanolammonium (CHEBI:132755)
Incoming Relation(s)
triethanolammonium (CHEBI:132755) is conjugate acid of triethanolamine (CHEBI:28621)
IUPAC Name 
2,2',2''-nitrilotriethanol
INN  Source
trolaminaWHO MedNet
Synonyms  Source
2,2',2''-NITRILOTRIETHANOLPDBeChem
2,2',2''-nitrilotris(ethanol)ChemIDplus
H3teaIUPAC
N(CH2CH2OH)3NIST Chemistry WebBook
nitrilo-2,2',2''-triethanolNIST Chemistry WebBook
nitrilotriethanolChemIDplus
Brand Name  Source
XerumenexChEMBL
Manual XrefsDatabases
211PDBeChem
2768DrugCentral
c0491UM-BBD
C06771KEGG COMPOUND
CPD0-2459MetaCyc
D00215KEGG DRUG
HMDB0032538HMDB
TriethanolamineWikipedia
Registry NumbersSources
Reaxys:1699263Reaxys
CAS:102-71-6ChemIDplus
CAS:102-71-6KEGG COMPOUND
CAS:102-71-6NIST Chemistry WebBook
Citations