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 No supplier information found for this compound.
Download Molfile XML SDF
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