CHEBI:132479 - N-stearoyltaurine

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ChEBI Name N-stearoyltaurine
ChEBI ID CHEBI:132479
ChEBI ASCII Name N-stearoyltaurine
Definition A fatty acid-taurine conjugate derived from stearic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C20H41NO4S
Net Charge 0
Average Mass 391.611
Monoisotopic Mass 391.27563
InChI InChI=1S/C20H41NO4S/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/h2-19H2,1H3,(H,21,22)(H,23,24,25)
InChIKey LMIJIHJZVURGQK-UHFFFAOYSA-N
SMILES C(C(NCCS(O)(=O)=O)=O)CCCCCCCCCCCCCCCC
Metabolite of Species Details
Mus musculus (NCBI:txid10090) See: PubMed
Roles Classification
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing N-stearoyltaurine (CHEBI:132479) has functional parent octadecanoic acid (CHEBI:28842)
N-stearoyltaurine (CHEBI:132479) has role mouse metabolite (CHEBI:75771)
N-stearoyltaurine (CHEBI:132479) is a fatty acid-taurine conjugate (CHEBI:132474)
N-stearoyltaurine (CHEBI:132479) is conjugate acid of N-stearoyltaurine(1−) (CHEBI:132047)
Incoming N-stearoyltaurine(1−) (CHEBI:132047) is conjugate base of N-stearoyltaurine (CHEBI:132479)
IUPAC Name
2-(octadecanoylamino)ethane-1-sulfonic acid
Synonyms Sources
N-octadecanoyl-taurine ChEBI
N-octadecanoyltaurine ChEBI
N-stearoyl taurine LIPID MAPS
N-stearoyl-taurine ChEBI
Manual Xref Database
LMFA08020078 LIPID MAPS
View more database links
Registry Number Type Source
17116739 Reaxys Registry Number Reaxys
Last Modified
07 July 2016