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CHEBI:88095 - N-hexanoylphytosphingosine

ChEBI IDCHEBI:88095
ChEBI NameN-hexanoylphytosphingosine
Stars
ASCII NameN-hexanoylphytosphingosine
DefinitionA phytoceramide in which the ceramide N-acyl group is specified as hexanoyl.
Last Modified8 October 2020
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC24H49NO4
Net Charge0
Average Mass415.659
Monoisotopic Mass415.36616
SMILESCCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@H](CO)NC(=O)CCCCC
InChIInChI=1S/C24H49NO4/c1-3-5-7-8-9-10-11-12-13-14-15-17-18-22(27)24(29)21(20-26)25-23(28)19-16-6-4-2/h21-22,24,26-27,29H,3-20H2,1-2H3,(H,25,28)/t21-,22+,24-/m0/s1
InChIKeyDAAZGMWCIAIMCL-ZDXQCDESSA-N
ChEBI Ontology
Outgoing Relation(s)
N-hexanoylphytosphingosine (CHEBI:88095) has functional parent hexanoic acid (CHEBI:30776)
N-hexanoylphytosphingosine (CHEBI:88095) is a phytoceramide (CHEBI:139051)
IUPAC Name 
N-[(2S,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]hexanamide
Synonyms  Source
Cer(t18:0/6:0)SUBMITTER
N-hexanoyl-4-hydroxysphinganineSUBMITTER
UniProt Name  Source
N-hexanoyl-(4R)-hydroxysphinganineUniProt
Registry NumbersSources
Reaxys:10777625Reaxys
Citations