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

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ChEBI Name 1-O-arachidonoyl-N-acetylsphingosine
ChEBI ID CHEBI:76080
ChEBI ASCII Name 1-O-arachidonoyl-N-acetylsphingosine
Definition A 1-O-acyl-N-acylsphingosine in which the N- and O-acyl groups are specified as acetyl and arachidonoyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Lucila Aimo
Supplier Information
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Formula C40H69NO4
Net Charge 0
Average Mass 627.98020
Monoisotopic Mass 627.52266
InChI InChI=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
InChIKey CMAAWROGDNJKGL-HLDXBUSGSA-N
SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](COC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC)NC(C)=O
ChEBI Ontology
Outgoing 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 Sources
1-(5Z,8Z,11Z,14Z)-eicosatetraenoyl-N-(acetyl)-sphing-4-enine UniProt
1-(5Z,8Z,11Z,14Z)-icosatetraenoyl-N-acetylsphingosine SUBMITTER
1-20:4(ω-6)-NAS SUBMITTER
1-arachidonoyl-N-acetylsphingosine ChEBI
Last Modified
14 January 2020