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CHEBI:179060 - Safingol ( L-threo-sphinganine)

ChEBI IDCHEBI:179060
ChEBI NameSafingol ( L-threo-sphinganine)
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H39NO2
Net Charge0
Average Mass301.515
Monoisotopic Mass301.29808
SMILESCCCCCCCCCCCCCCC[C@H](O)[C@@H](N)CO
InChIInChI=1S/C18H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h17-18,20-21H,2-16,19H2,1H3/t17-,18-/m0/s1
InChIKeyOTKJDMGTUTTYMP-ROUUACIJSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Safingol ( L-threo-sphinganine) (CHEBI:179060) is a amino alcohol (CHEBI:22478)
IUPAC Name 
(2S,3S)-2-aminooctadecane-1,3-diol
Manual XrefsDatabases
2319840ChemSpider
DB11924DrugBank
D05784KEGG DRUG
LMSP01080055LIPID MAPS
Registry NumbersSources
CAS:15639-50-6ChemIDplus