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CHEBI:77952 - D-glucosyl-N-hexanoylsphingosine

ChEBI IDCHEBI:77952
ChEBI NameD-glucosyl-N-hexanoylsphingosine
Stars
ASCII NameD-glucosyl-N-hexanoylsphingosine
DefinitionA D-glucosyl-N-acylsphingosine in which the ceramide N-acyl group is specified as hexanoyl.
Last Modified9 June 2014
Submitternhn
DownloadsMolfile
FormulaC30H57NO8
Net Charge0
Average Mass559.785
Monoisotopic Mass559.40842
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)CCCCC
InChIInChI=1S/C30H57NO8/c1-3-5-7-8-9-10-11-12-13-14-15-16-18-19-24(33)23(31-26(34)20-17-6-4-2)22-38-30-29(37)28(36)27(35)25(21-32)39-30/h18-19,23-25,27-30,32-33,35-37H,3-17,20-22H2,1-2H3,(H,31,34)/b19-18+/t23-,24+,25+,27+,28-,29+,30?/m0/s1
InChIKeyHLMBHWREYRYNOF-WVDXBQOZSA-N
Roles Classification
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
D-glucosyl-N-hexanoylsphingosine (CHEBI:77952) is a D-glucosyl-N-acylsphingosine (CHEBI:18368)
IUPAC Name 
N-[(2S,3R,4E)-1-(D-glucopyranosyloxy)-3-hydroxyoctadec-4-en-2-yl]hexanamide
UniProt Name  Source
D-glucosyl-N-(hexanoyl)sphing-4-enineUniProt
Registry NumbersSources
Reaxys:23452340Reaxys
Citations