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CHEBI:146191 - N-oleoyltaurine(1−)

ChEBI IDCHEBI:146191
ChEBI NameN-oleoyltaurine(1−)
Stars
ASCII NameN-oleoyltaurine(1-)
DefinitionA fatty acid-taurine conjugate obtained by deprotonation of the sulfonate group of N-oleoyltaurine; major species at pH 7.3.
Last Modified20 February 2020
Submitterlaimo
DownloadsMolfile
FormulaC20H38NO4S
Net Charge-1
Average Mass388.594
Monoisotopic Mass388.25270
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)NCCS(=O)(=O)[O-]
InChIInChI=1S/C20H39NO4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(22)21-18-19-26(23,24)25/h9-10H,2-8,11-19H2,1H3,(H,21,22)(H,23,24,25)/p-1/b10-9-
InChIKeyKOGRJTUIKPMZEJ-KTKRTIGZSA-M
ChEBI Ontology
Outgoing Relation(s)
N-oleoyltaurine(1−) (CHEBI:146191) is a fatty acid-taurine conjugate(1−) (CHEBI:132040)
N-oleoyltaurine(1−) (CHEBI:146191) is conjugate base of N-oleoyltaurine (CHEBI:146206)
Incoming Relation(s)
N-oleoyltaurine (CHEBI:146206) is conjugate acid of N-oleoyltaurine(1−) (CHEBI:146191)
IUPAC Name 
2-[(9Z)-octadec-9-enoylamino]ethanesulfonate
Synonyms  Source
N-(9Z-octadecenoyl)taurine(1−)SUBMITTER
C18:1(9Z) NAT(1−)SUBMITTER
2-{[(9Z)-octadec-9-enoyl]amino}ethane-1-sulfonateIUPAC
UniProt Name  Source
N-(9Z-octadecenoyl)-taurineUniProt
Citations