CHEBI:76086 - 1-O-linoleoyl-N-acetylsphingosine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-O-linoleoyl-N-acetylsphingosine
ChEBI ID CHEBI:76086
ChEBI ASCII Name 1-O-linoleoyl-N-acetylsphingosine
Definition A 1-O-acyl-N-acylsphingosine in which the N- and O-acyl groups are specified as acetyl and linoleoyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Lucila Aimo
Supplier Information
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Formula C38H69NO4
Net Charge 0
Average Mass 603.95880
Monoisotopic Mass 603.52266
InChI InChI=1S/C38H69NO4/c1-4-6-8-10-12-14-16-18-19-21-23-25-27-29-31-33-38(42)43-34-36(39-35(3)40)37(41)32-30-28-26-24-22-20-17-15-13-11-9-7-5-2/h12,14,18-19,30,32,36-37,41H,4-11,13,15-17,20-29,31,33-34H2,1-3H3,(H,39,40)/b14-12-,19-18-,32-30+/t36-,37+/m0/s1
InChIKey GGAKJIWSJJGHDP-HLWMWBLXSA-N
SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](COC(=O)CCCCCCC\C=C/C\C=C/CCCCC)NC(C)=O
ChEBI Ontology
Outgoing 1-O-linoleoyl-N-acetylsphingosine (CHEBI:76086) has functional parent N-acetylsphingosine (CHEBI:46979)
1-O-linoleoyl-N-acetylsphingosine (CHEBI:76086) has functional parent linoleic acid (CHEBI:17351)
1-O-linoleoyl-N-acetylsphingosine (CHEBI:76086) is a 1-O-acyl-N-acetylsphingosine (CHEBI:84483)
IUPAC Name
(2S,3R,4E)-2-acetamido-3-hydroxyoctadec-4-en-1-yl (9Z,12Z)-octadeca-9,12-dienoate
Synonyms Sources
1-(9Z,12Z-octadecadienoyl)-N-acetylsphing-4-enine UniProt
1-18:2(ω-6)-NAS SUBMITTER
1-linoleoyl-N-acetylsphingosine ChEBI
1-O-[(9Z,12Z)-octadecadienoyl]-N-acetylsphingosine ChEBI
Last Modified
09 April 2015