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CHEBI:132045 - N-hexadecanoyltaurine(1−)

ChEBI IDCHEBI:132045
ChEBI NameN-hexadecanoyltaurine(1−)
Stars
ASCII NameN-hexadecanoyltaurine(1-)
DefinitionA fatty acid-taurine conjugate obtained by deprotonation of the sulfonate group of N-hexadecanoyltaurine; major species at pH 7.3.
Last Modified7 July 2016
Submitterlaimo
DownloadsMolfile
FormulaC18H36NO4S
Net Charge-1
Average Mass362.556
Monoisotopic Mass362.23705
SMILESCCCCCCCCCCCCCCCC(=O)NCCS(=O)(=O)[O-]
InChIInChI=1S/C18H37NO4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17-24(21,22)23/h2-17H2,1H3,(H,19,20)(H,21,22,23)/p-1
InChIKeyLPDJCYFKKSLKRO-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
N-hexadecanoyltaurine(1−) (CHEBI:132045) is a fatty acid-taurine conjugate(1−) (CHEBI:132040)
N-hexadecanoyltaurine(1−) (CHEBI:132045) is conjugate base of N-hexadecanoyltaurine (CHEBI:132477)
Incoming Relation(s)
N-hexadecanoyltaurine (CHEBI:132477) is conjugate acid of N-hexadecanoyltaurine(1−) (CHEBI:132045)
IUPAC Name 
2-(hexadecanoylamino)ethane-1-sulfonate
Synonyms  Source
N-hexadecanoyl-taurine(1−)SUBMITTER
N-palmitoyl-taurine(1−)ChEBI
N-palmitoyltaurine(1−)ChEBI
UniProt Name  Source
N-hexadecanoyl-taurineUniProt
Citations