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CHEBI:146198 - N-nervonoyltaurine(1−)

ChEBI IDCHEBI:146198
ChEBI NameN-nervonoyltaurine(1−)
Stars
ASCII NameN-nervonoyltaurine(1-)
DefinitionA fatty acid-taurine conjugate obtained by deprotonation of the sulfonate group of N-nervonoyltaurine; major species at pH 7.3.
Last Modified10 March 2020
Submitterlaimo
DownloadsMolfile
FormulaC26H50NO4S
Net Charge-1
Average Mass472.756
Monoisotopic Mass472.34660
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)NCCS(=O)(=O)[O-]
InChIInChI=1S/C26H51NO4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26(28)27-24-25-32(29,30)31/h9-10H,2-8,11-25H2,1H3,(H,27,28)(H,29,30,31)/p-1/b10-9-
InChIKeyQIEYQUYASMRRHE-KTKRTIGZSA-M
ChEBI Ontology
Outgoing Relation(s)
N-nervonoyltaurine(1−) (CHEBI:146198) is a fatty acid-taurine conjugate(1−) (CHEBI:132040)
N-nervonoyltaurine(1−) (CHEBI:146198) is conjugate base of N-nervonoyltaurine (CHEBI:146294)
Incoming Relation(s)
N-nervonoyltaurine (CHEBI:146294) is conjugate acid of N-nervonoyltaurine(1−) (CHEBI:146198)
IUPAC Name 
2-[(15Z)-tetracos-15-enoylamino]ethanesulfonate
Synonyms  Source
C24:1(15Z) NAT(1−)SUBMITTER
2-{[(15Z)-tetracos-15-enoyl]amino}ethane-1-sulfonateIUPAC
UniProt Name  Source
N-(15Z-tetracosenoyl)-taurineUniProt
Citations