EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:143845 - Cer(d16:1(4E)(1OH,3OH)(15Me)/25:0(2OH[R]))

Default Structure
ChEBI IDCHEBI:143845
ChEBI NameCer(d16:1(4E)(1OH,3OH)(15Me)/25:0(2OH[R]))
Stars
SubmitterMichael Witting
DownloadsMolfile
FormulaC42H83NO4
Net Charge0
Average Mass666.129
Monoisotopic Mass665.63221
SMILESCCCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CO)[C@H](O)/C=C/CCCCCCCCCC(C)C
InChIInChI=1S/C42H83NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-27-30-33-36-41(46)42(47)43-39(37-44)40(45)35-32-29-26-24-21-22-25-28-31-34-38(2)3/h32,35,38-41,44-46H,4-31,33-34,36-37H2,1-3H3,(H,43,47)/b35-32+/t39-,40+,41+/m0/s1
InChIKeyDNHYUZGAHLGOLG-WWWJBYAKSA-N
ChEBI Ontology
Outgoing Relation(s)
Cer(d16:1(4E)(1OH,3OH)(15Me)/25:0(2OH[R])) (CHEBI:143845) is a organic molecular entity (CHEBI:50860)