EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:143840 - Cer(d16:1(4E)(1OH,3OH)(15Me)/29:0)

Default Structure
ChEBI IDCHEBI:143840
ChEBI NameCer(d16:1(4E)(1OH,3OH)(15Me)/29:0)
Stars
SubmitterMichael Witting
DownloadsMolfile
FormulaC46H91NO3
Net Charge0
Average Mass706.238
Monoisotopic Mass705.69990
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)/C=C/CCCCCCCCCC(C)C
InChIInChI=1S/C46H91NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29-32-35-38-41-46(50)47-44(42-48)45(49)40-37-34-31-28-26-27-30-33-36-39-43(2)3/h37,40,43-45,48-49H,4-36,38-39,41-42H2,1-3H3,(H,47,50)/b40-37+/t44-,45+/m0/s1
InChIKeyXUQGJZUJCBDLOD-SVYKYBGCSA-N
ChEBI Ontology
Outgoing Relation(s)
Cer(d16:1(4E)(1OH,3OH)(15Me)/29:0) (CHEBI:143840) is a organic molecular entity (CHEBI:50860)