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CHEBI:83248 - N-(2-hydroxyhexanoyl)sphinganine

ChEBI IDCHEBI:83248
ChEBI NameN-(2-hydroxyhexanoyl)sphinganine
Stars
ASCII NameN-(2-hydroxyhexanoyl)sphinganine
DefinitionAn N-(2-hydroxyacyl)sphinganine in which the ceramide N-acyl group is specified as 2-hydroxyhexanoyl.
Last Modified3 December 2014
Submitternhn
DownloadsMolfile
FormulaC24H49NO4
Net Charge0
Average Mass415.659
Monoisotopic Mass415.36616
SMILESCCCCCCCCCCCCCCC[C@@H](O)[C@H](CO)NC(=O)C(O)CCCC
InChIInChI=1S/C24H49NO4/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-19-22(27)21(20-26)25-24(29)23(28)18-6-4-2/h21-23,26-28H,3-20H2,1-2H3,(H,25,29)/t21-,22+,23?/m0/s1
InChIKeyIBQAJPHETRMPLD-ZVTBYLAHSA-N
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
N-(2-hydroxyhexanoyl)sphinganine (CHEBI:83248) is a N-(2-hydroxyacyl)sphinganine (CHEBI:83247)
IUPAC Name 
N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]-2-hydroxyhexanamide
UniProt Name  Source
N-(2-hydroxy-hexanoyl)-sphinganineUniProt
Citations