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CHEBI:85206 - N-arachidonoylsphinganine

ChEBI IDCHEBI:85206
ChEBI NameN-arachidonoylsphinganine
Stars
ASCII NameN-arachidonoylsphinganine
DefinitionA dihydroceramide in which the N-acyl group is specified as arachidonoyl.
Last Modified7 May 2015
Submitterlaimo
DownloadsMolfile
FormulaC38H69NO3
Net Charge0
Average Mass587.974
Monoisotopic Mass587.52775
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)N[C@@H](CO)[C@H](O)CCCCCCCCCCCCCCC
InChIInChI=1S/C38H69NO3/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-38(42)39-36(35-40)37(41)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h11,13,17-18,20,22,26,28,36-37,40-41H,3-10,12,14-16,19,21,23-25,27,29-35H2,1-2H3,(H,39,42)/b13-11-,18-17-,22-20-,28-26-/t36-,37+/m0/s1
InChIKeyNXKPWQUXGKASPM-AJIQFNDCSA-N
Roles Classification
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
N-arachidonoylsphinganine (CHEBI:85206) has functional parent arachidonic acid (CHEBI:15843)
N-arachidonoylsphinganine (CHEBI:85206) is a N-acylsphinganine (CHEBI:31488)
IUPAC Name 
(5Z,8Z,11Z,14Z)-N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]icosa-5,8,11,14-tetraenamide
Synonyms  Source
Cer(d18:0/20:4n-6)SUBMITTER
DHCer C20:4(n-6)SUBMITTER
N-arachidonoyldihydrosphingosineChEBI
N-(5Z,8Z,11Z,14Z-icosatetraenoyl)dihydrosphingosineChEBI
N-(5Z,8Z,11Z,14Z-icosatetraenoyl)sphinganineChEBI
N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)dihydrosphingosineChEBI
UniProt Name  Source
N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sphinganineUniProt