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CHEBI:84713 - β-D-glucosyl-(1↔1')-N-[(17Z)-hexacosenoyl]sphinganine

ChEBI IDCHEBI:84713
ChEBI Nameβ-D-glucosyl-(1↔1')-N-[(17Z)-hexacosenoyl]sphinganine
Stars
ASCII Namebeta-D-glucosyl-(1<->1')-N-[(17Z)-hexacosenoyl]sphinganine
DefinitionA β-D-glucosyl-(1↔1')-N-acylsphinganine in which the acyl group specified is (17Z)-hexacosenoyl.
Last Modified5 February 2015
Submitternamrata
DownloadsMolfile
FormulaC50H97NO8
Net Charge0
Average Mass840.325
Monoisotopic Mass839.72142
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCCCC(=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/C50H97NO8/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-46(54)51-43(42-58-50-49(57)48(56)47(55)45(41-52)59-50)44(53)39-37-35-33-31-29-27-16-14-12-10-8-6-4-2/h17-18,43-45,47-50,52-53,55-57H,3-16,19-42H2,1-2H3,(H,51,54)/b18-17-/t43-,44+,45+,47+,48-,49+,50+/m0/s1
InChIKeyBSRSUMIOOGETSD-BNIYAIRKSA-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-[(17Z)-hexacosenoyl]sphinganine (CHEBI:84713) has functional parent (17Z)-hexacosenoic acid (CHEBI:77525)
β-D-glucosyl-(1↔1')-N-[(17Z)-hexacosenoyl]sphinganine (CHEBI:84713) has role mouse metabolite (CHEBI:75771)
β-D-glucosyl-(1↔1')-N-[(17Z)-hexacosenoyl]sphinganine (CHEBI:84713) is a β-D-glucosyl-(1↔1')-N-acylsphinganine (CHEBI:82919)
IUPAC Name 
(17Z)-N-[(2S,3R)-1-(β-D-glucopyranosyloxy)-3-hydroxyoctadecan-2-yl]hexacos-17-enamide
Synonyms  Source
N-(17Z-hexacosenoyl)-1-β-glucosyl-sphinganineLIPID MAPS
C26:1DH GlcCerLIPID MAPS
GlcCer(d18:0/26:1(17Z))LIPID MAPS
Manual XrefsDatabases
LMSP0501AA24LIPID MAPS