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CHEBI:143838 - Cer(d16:1(4E)(1OH,3OH)(15Me)/28:0(2OH[R]))

Default Structure
ChEBI IDCHEBI:143838
ChEBI NameCer(d16:1(4E)(1OH,3OH)(15Me)/28:0(2OH[R]))
Stars
SubmitterMichael Witting
DownloadsMolfile
FormulaC45H89NO4
Net Charge0
Average Mass708.210
Monoisotopic Mass707.67916
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CO)[C@H](O)/C=C/CCCCCCCCCC(C)C
InChIInChI=1S/C45H89NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-30-33-36-39-44(49)45(50)46-42(40-47)43(48)38-35-32-29-27-24-25-28-31-34-37-41(2)3/h35,38,41-44,47-49H,4-34,36-37,39-40H2,1-3H3,(H,46,50)/b38-35+/t42-,43+,44+/m0/s1
InChIKeyPFLNVQWDBPBFRS-BAFGQMMDSA-N
ChEBI Ontology
Outgoing Relation(s)
Cer(d16:1(4E)(1OH,3OH)(15Me)/28:0(2OH[R])) (CHEBI:143838) is a organic molecular entity (CHEBI:50860)