EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:233905 - hexanoyltaurine

ChEBI IDCHEBI:233905
ChEBI Namehexanoyltaurine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H17NO4S
Net Charge0
Average Mass223.294
Monoisotopic Mass223.08783
SMILESCCCCCC(=O)NCCS(=O)(=O)O
InChIInChI=1S/C8H17NO4S/c1-2-3-4-5-8(10)9-6-7-14(11,12)13/h2-7H2,1H3,(H,9,10)(H,11,12,13)
InChIKeyADFXUGRCALOSKU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
hexanoyltaurine (CHEBI:233905) is a fatty amide (CHEBI:29348)
IUPAC Name 
2-(hexanoylamino)ethanesulonic acid
Manual XrefsDatabases
1680723ChemSpider