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CHEBI:177407 - 2-Amino-3-hydroxy-15-methyl-1-hexadecanesulfonic acid

ChEBI IDCHEBI:177407
ChEBI Name2-Amino-3-hydroxy-15-methyl-1-hexadecanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H37NO4S
Net Charge0
Average Mass351.553
Monoisotopic Mass351.24433
SMILESCC(C)CCCCCCCCCCCC(O)C(N)CS(=O)(=O)O
InChIInChI=1S/C17H37NO4S/c1-15(2)12-10-8-6-4-3-5-7-9-11-13-17(19)16(18)14-23(20,21)22/h15-17,19H,3-14,18H2,1-2H3,(H,20,21,22)
InChIKeyXMTQSVIYISYLNK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) Sausage (ENVO:00002166) MetaboLights (MTBLS2871)
ChEBI Ontology
Outgoing Relation(s)
2-Amino-3-hydroxy-15-methyl-1-hexadecanesulfonic acid (CHEBI:177407) is a organosulfonic acid (CHEBI:33551)
IUPAC Name 
2-amino-3-hydroxy-15-methylhexadecane-1-sulonic acid
Manual XrefsDatabases
169799ChemSpider
Registry NumbersSources
CAS:76187-10-5ChemIDplus