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CHEBI:72959 - N-hexadecanoylsphingosine

ChEBI IDCHEBI:72959
ChEBI NameN-hexadecanoylsphingosine
Stars
ASCII NameN-hexadecanoylsphingosine
DefinitionA N-acylsphingosine in which the ceramide N-acyl group is specified as hexadecanoyl (palmitoyl).
Secondary ChEBI IDCHEBI:39603
Last Modified13 October 2020
SubmitterAlan Bridge
DownloadsMolfile
FormulaC34H67NO3
Net Charge0
Average Mass537.914
Monoisotopic Mass537.51210
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)NC(=O)CCCCCCCCCCCCCCC
InChIInChI=1S/C34H67NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(37)32(31-36)35-34(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h27,29,32-33,36-37H,3-26,28,30-31H2,1-2H3,(H,35,38)/b29-27+/t32-,33+/m0/s1
InChIKeyYDNKGFDKKRUKPY-TURZORIXSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood (UBERON:0000178) PubMed (20671299)
Mycoplasma genitalium (ncbitaxon:2097) - PubMed (22817898)
Roles Classification
Biological Roles:
Mycoplasma genitalium metabolite  Any bacterial metabolite produced during a metabolic reaction in Mycoplasma genitalium.
human blood serum metabolite  Any metabolite (endogenous or exogenous) found in human blood serum samples.
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
N-hexadecanoylsphingosine (CHEBI:72959) has functional parent hexadecanoic acid (CHEBI:15756)
N-hexadecanoylsphingosine (CHEBI:72959) has role Mycoplasma genitalium metabolite (CHEBI:131604)
N-hexadecanoylsphingosine (CHEBI:72959) has role human blood serum metabolite (CHEBI:85234)
N-hexadecanoylsphingosine (CHEBI:72959) is a N-acylsphingosine (CHEBI:52639)
N-hexadecanoylsphingosine (CHEBI:72959) is a N-palmitoyl-sphingoid base (CHEBI:144703)
N-hexadecanoylsphingosine (CHEBI:72959) is a Cer(d34:1) (CHEBI:137569)
IUPAC Name 
N-[(2S,3R,4E)-1,3-dihydroxyoctadec-4-en-2-yl]hexadecanamide
Synonyms  Source
(2S,3R,4E)-2-acylamino-1,3-octadec-4-enediolHMDB
(2S,3R,4E)-2-acylaminooctadec-4-ene-1,3-diolHMDB
C16-0(Palmitoyl)ceramideChemIDplus
C16 CerLIPID MAPS
C16 CeramideChEBI
Ceramide (d18:1/16:0)HMDB
UniProt Name  Source
N-hexadecanoylsphing-4-enineUniProt
Manual XrefsDatabases
16CPDBeChem
FDB023536FooDB
HMDB0004949HMDB
LMSP02010004LIPID MAPS
Registry NumbersSources
Reaxys:1717423Reaxys
CAS:4201-58-5ChemIDplus
Citations