CHEBI:76077 - 1-O-palmitoyl-N-acetylsphingosine

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ChEBI Name 1-O-palmitoyl-N-acetylsphingosine
ChEBI ID CHEBI:76077
ChEBI ASCII Name 1-O-palmitoyl-N-acetylsphingosine
Definition A 1-O-acyl-N-acylsphingosine in which the N- and O-acyl groups are specified as acetyl and palmitoyl (hexadecanoyl) respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Lucila Aimo
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Formula C36H69NO4
Net Charge 0
Average Mass 579.93740
Monoisotopic Mass 579.52266
InChI InChI=1S/C36H69NO4/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-35(39)34(37-33(3)38)32-41-36(40)31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h28,30,34-35,39H,4-27,29,31-32H2,1-3H3,(H,37,38)/b30-28+/t34-,35+/m0/s1
InChIKey YHEINVWEQIWYCT-LQSBSTQLSA-N
SMILES CCCCCCCCCCCCCCCC(=O)OC[C@H](NC(C)=O)[C@H](O)\C=C\CCCCCCCCCCCCC
ChEBI Ontology
Outgoing 1-O-palmitoyl-N-acetylsphingosine (CHEBI:76077) has functional parent N-acetylsphingosine (CHEBI:46979)
1-O-palmitoyl-N-acetylsphingosine (CHEBI:76077) has functional parent hexadecanoic acid (CHEBI:15756)
1-O-palmitoyl-N-acetylsphingosine (CHEBI:76077) is a 1-O-acyl-N-acetylsphingosine (CHEBI:84483)
IUPAC Name
(2S,3R,4E)-2-acetamido-3-hydroxyoctadec-4-en-1-yl hexadecanoate
Synonyms Sources
(2S,3R,4E)-2-acetamido-3-hydroxyoctadec-4-en-1-yl palmitate IUPAC
1-16:0-NAS SUBMITTER
1-hexadecanoyl-N-(acetyl)-sphing-4-enine UniProt
1-O-hexadecanoyl-N-acetylsphingosine ChEBI
1-palmitoyl-N-acetylsphingosine ChEBI
Last Modified
14 January 2020