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CHEBI:230300 - Trihexosylceramide (d18:1/16:0)

ChEBI IDCHEBI:230300
ChEBI NameTrihexosylceramide (d18:1/16:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC52H97NO18
Net Charge0
Average Mass1024.337
Monoisotopic Mass1023.67057
SMILESCCCCCCCCCCCCC/C=C/C(O)C(COC1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C1O)NC(=O)CCCCCCCCCCCCCCC
InChIInChI=1S/C52H97NO18/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-36(57)35(53-40(58)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)34-66-50-46(64)43(61)48(38(32-55)68-50)71-52-47(65)44(62)49(39(33-56)69-52)70-51-45(63)42(60)41(59)37(31-54)67-51/h27,29,35-39,41-52,54-57,59-65H,3-26,28,30-34H2,1-2H3,(H,53,58)/b29-27+
InChIKeyMGOOTGNGBOPVIV-ORIPQNMZSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
Trihexosylceramide (d18:1/16:0) (CHEBI:230300) is a glycosphingolipid (CHEBI:24402)
IUPAC Name 
N-[(E)-1-[5-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoctadec-4-en-2-yl]hexadecanamide
Manual XrefsDatabases
16744892ChemSpider
HMDB0004879HMDB