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CHEBI:76080 - 1-O-arachidonoyl-N-acetylsphingosine

ChEBI IDCHEBI:76080
ChEBI Name1-O-arachidonoyl-N-acetylsphingosine
Stars
ASCII Name1-O-arachidonoyl-N-acetylsphingosine
DefinitionA 1-O-acyl-N-acylsphingosine in which the N- and O-acyl groups are specified as acetyl and arachidonoyl respectively.
Last Modified14 January 2020
Submitterlaimo
DownloadsMolfile
FormulaC40H69NO4
Net Charge0
Average Mass627.995
Monoisotopic Mass627.52266
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](NC(C)=O)[C@H](O)/C=C/CCCCCCCCCCCCC
InChIInChI=1S/C40H69NO4/c1-4-6-8-10-12-14-16-18-19-20-21-23-25-27-29-31-33-35-40(44)45-36-38(41-37(3)42)39(43)34-32-30-28-26-24-22-17-15-13-11-9-7-5-2/h12,14,18-19,21,23,27,29,32,34,38-39,43H,4-11,13,15-17,20,22,24-26,28,30-31,33,35-36H2,1-3H3,(H,41,42)/b14-12-,19-18-,23-21-,29-27-,34-32+/t38-,39+/m0/s1
InChIKeyCMAAWROGDNJKGL-HLDXBUSGSA-N
ChEBI Ontology
Outgoing Relation(s)
1-O-arachidonoyl-N-acetylsphingosine (CHEBI:76080) has functional parent N-acetylsphingosine (CHEBI:46979)
1-O-arachidonoyl-N-acetylsphingosine (CHEBI:76080) has functional parent arachidonic acid (CHEBI:15843)
1-O-arachidonoyl-N-acetylsphingosine (CHEBI:76080) is a 1-O-acyl-N-acetylsphingosine (CHEBI:84483)
IUPAC Name 
(2S,3R,4E)-2-acetamido-3-hydroxyoctadec-4-en-1-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate
Synonyms  Source
1-(5Z,8Z,11Z,14Z)-icosatetraenoyl-N-acetylsphingosineSUBMITTER
1-20:4(ω-6)-NASSUBMITTER
1-arachidonoyl-N-acetylsphingosineChEBI
UniProt Name  Source
1-(5Z,8Z,11Z,14Z)-eicosatetraenoyl-N-(acetyl)-sphing-4-enineUniProt