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CHEBI:76074 - 1-O-stearoyl-N-acetylsphingosine

ChEBI IDCHEBI:76074
ChEBI Name1-O-stearoyl-N-acetylsphingosine
Stars
ASCII Name1-O-stearoyl-N-acetylsphingosine
DefinitionA 1-O-acyl-N-acylsphingosine in which the N- and O-acyl groups are specified as acetyl and stearoyl (octadecanoyl) respectively.
Last Modified14 January 2020
Submitterlaimo
DownloadsMolfile
FormulaC38H73NO4
Net Charge0
Average Mass608.005
Monoisotopic Mass607.55396
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COC(=O)CCCCCCCCCCCCCCCCC)NC(C)=O
InChIInChI=1S/C38H73NO4/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/h30,32,36-37,41H,4-29,31,33-34H2,1-3H3,(H,39,40)/b32-30+/t36-,37+/m0/s1
InChIKeyGQVQVSKCUMRWET-PQCGLYSKSA-N
ChEBI Ontology
Outgoing Relation(s)
1-O-stearoyl-N-acetylsphingosine (CHEBI:76074) has functional parent N-acetylsphingosine (CHEBI:46979)
1-O-stearoyl-N-acetylsphingosine (CHEBI:76074) has functional parent octadecanoic acid (CHEBI:28842)
1-O-stearoyl-N-acetylsphingosine (CHEBI:76074) is a 1-O-acyl-N-acetylsphingosine (CHEBI:84483)
IUPAC Name 
(2S,3R,4E)-2-acetamido-3-hydroxyoctadec-4-en-1-yl octadecanoate
Synonyms  Source
1-stearoyl-N-acetylsphingosineChEBI
1-O-octadecanoyl-N-acetylsphingosineChEBI
(2S,3R,4E)-2-acetamido-3-hydroxyoctadec-4-en-1-yl stearateIUPAC
UniProt Name  Source
1-octadecanoyl-N-(acetyl)-sphing-4-enineUniProt