EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:72956 - N-dodecanoylsphingosine

ChEBI IDCHEBI:72956
ChEBI NameN-dodecanoylsphingosine
Stars
ASCII NameN-dodecanoylsphingosine
DefinitionA N-acylsphingosine in which the ceramide N-acyl group is specified as dodecanoyl (lauroyl).
Last Modified23 October 2015
SubmitterAlan Bridge
DownloadsMolfile
FormulaC30H59NO3
Net Charge0
Average Mass481.806
Monoisotopic Mass481.44949
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)NC(=O)CCCCCCCCCCC
InChIInChI=1S/C30H59NO3/c1-3-5-7-9-11-13-14-15-16-18-19-21-23-25-29(33)28(27-32)31-30(34)26-24-22-20-17-12-10-8-6-4-2/h23,25,28-29,32-33H,3-22,24,26-27H2,1-2H3,(H,31,34)/b25-23+/t28-,29+/m0/s1
InChIKeyHXFPPRPLRSPNIB-VARSQMIESA-N
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
N-dodecanoylsphingosine (CHEBI:72956) has functional parent dodecanoic acid (CHEBI:30805)
N-dodecanoylsphingosine (CHEBI:72956) is a N-acylsphingosine (CHEBI:52639)
IUPAC Name 
N-[(2S,3R,4E)-1,3-dihydroxyoctadec-4-en-2-yl]dodecanamide
Synonyms  Source
Cer(d18:1/12:0)LIPID MAPS
N-lauroylsphingosineChEBI
N-dodecanoylsphing-4-enineSUBMITTER
N-(dodecanoyl)sphing-4-enineSUBMITTER
N-lauroylsphing-4-enineChEBI
N-(lauroyl)sphing-4-enineChEBI
UniProt Name  Source
N-dodecanoylsphing-4-enineUniProt
Manual XrefsDatabases
LMSP02010002LIPID MAPS
Registry NumbersSources
Reaxys:1717021Reaxys
CAS:74713-60-3ChemIDplus