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CHEBI:67041 - N-(2-hydroxyoctadecanoyl)-4-hydroxysphinganine

ChEBI IDCHEBI:67041
ChEBI NameN-(2-hydroxyoctadecanoyl)-4-hydroxysphinganine
Stars
ASCII NameN-(2-hydroxyoctadecanoyl)-4-hydroxysphinganine
DefinitionA phytoceramide in which the ceramide N-acyl group is specified as 2-hydroxyoctadecanoyl
Last Modified20 August 2012
SubmitterAlan Bridge
DownloadsMolfile
FormulaC36H73NO5
Net Charge0
Average Mass599.982
Monoisotopic Mass599.54887
SMILESCCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](CO)[C@H](O)[C@H](O)CCCCCCCCCCCCCC
InChIInChI=1S/C36H73NO5/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-34(40)36(42)37-32(31-38)35(41)33(39)29-27-25-23-21-19-16-14-12-10-8-6-4-2/h32-35,38-41H,3-31H2,1-2H3,(H,37,42)/t32-,33+,34?,35-/m0/s1
InChIKeyBBAFBDLICMHBNU-MFZOPHKMSA-N
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
N-(2-hydroxyoctadecanoyl)-4-hydroxysphinganine (CHEBI:67041) is a N-acylphytosphingosine (CHEBI:31998)
IUPAC Name 
2-hydroxy-N-[(2S,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]octadecanamide
Synonyms  Source
PHC-C 18:0/18:0SUBMITTER
Cer(t18:0/18:0(2OH))SUBMITTER
N-(2-hydroxyoctadecanoyl)phytoceramideChEBI
N-(2-hydroxyoctadecanoyl)phytosphingosineChEBI
N-(2-hydroxyoctadecanoyl)-4R-hydroxysphinganineLIPID MAPS
N-(2-hydroxyoctadecanoyl)-hydroxysphinganineLIPID MAPS
Manual XrefsDatabases
LMSP02030016LIPID MAPS
CPD-8453MetaCyc
Registry NumbersSources
Reaxys:8963972Reaxys