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CHEBI:84782 - β-D-glucosyl-(1↔1')-N-hexadecanoylsphinganine

ChEBI IDCHEBI:84782
ChEBI Nameβ-D-glucosyl-(1↔1')-N-hexadecanoylsphinganine
Stars
ASCII Namebeta-D-glucosyl-(1<->1')-N-hexadecanoylsphinganine
DefinitionA β-D-glucosyl-(1↔1')-N-acylsphinganine in which the acyl group specified is hexadecanoyl.
Last Modified10 December 2021
Submitternamrata
DownloadsMolfile
FormulaC40H79NO8
Net Charge0
Average Mass702.071
Monoisotopic Mass701.58057
SMILESCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CCCCCCCCCCCCCCC
InChIInChI=1S/C40H79NO8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(43)33(32-48-40-39(47)38(46)37(45)35(31-42)49-40)41-36(44)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33-35,37-40,42-43,45-47H,3-32H2,1-2H3,(H,41,44)/t33-,34+,35+,37+,38-,39+,40+/m0/s1
InChIKeyBLGKYYVFGMKTEZ-UKDORTLVSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - MetaboLights (MTBLS143)
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
β-D-glucosyl-(1↔1')-N-hexadecanoylsphinganine (CHEBI:84782) has functional parent hexadecanoic acid (CHEBI:15756)
β-D-glucosyl-(1↔1')-N-hexadecanoylsphinganine (CHEBI:84782) has role mouse metabolite (CHEBI:75771)
β-D-glucosyl-(1↔1')-N-hexadecanoylsphinganine (CHEBI:84782) is a β-D-glucosyl-(1↔1')-N-acylsphinganine (CHEBI:82919)
IUPAC Name 
N-[(2S,3R)-1-(β-D-glucopyranosyloxy)-3-hydroxyoctadecan-2-yl]hexadecanamide
Synonyms  Source
β-D-glucosyl-(1↔1')-N-palmitoylsphinganineChEBI
N-(hexadecanoyl)-1-β-glucosyl-sphinganineLIPID MAPS
C16DH GlcCerLIPID MAPS
GlcCer(d18:0/16:0)LIPID MAPS
UniProt Name  Source
β-D-glucosyl-(1↔1')-N-hexadecanoylsphinganineUniProt
Manual XrefsDatabases
LMSP0501AA04LIPID MAPS