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CHEBI:751537 - coleneuramide

Default Structure
ChEBI IDCHEBI:751537
ChEBI Namecoleneuramide
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC39H68N2O8
Net Charge0
Average Mass692.979
Monoisotopic Mass692.49757
SMILES[H][C@@]1([C@H](O)[C@H](O)CO)O[C@@](OC)(C(=O)N[C@@H]2CC[C@@]3(C)[C@@]([H])(CC[C@]4([H])[C@]3([H])CC[C@@]3(C)[C@@]4([H])CC[C@]3([H])[C@H](C)CCCC(C)C)C2)C[C@H](O)[C@H]1NC(C)=O
InChIInChI=1S/C39H68N2O8/c1-22(2)9-8-10-23(3)28-13-14-29-27-12-11-25-19-26(15-17-37(25,5)30(27)16-18-38(28,29)6)41-36(47)39(48-7)20-31(44)33(40-24(4)43)35(49-39)34(46)32(45)21-42/h22-23,25-35,42,44-46H,8-21H2,1-7H3,(H,40,43)(H,41,47)/t23-,25+,26-,27+,28-,29+,30+,31+,32-,33-,34-,35-,37+,38-,39-/m1/s1
InChIKeyCHMRTBYTCBDIRG-JQZMMWJVSA-N
ChEBI Ontology
Outgoing Relation(s)
coleneuramide (CHEBI:751537) is a cholestanoid (CHEBI:50401)
INNs  Source
coleneuramidaWHO MedNet
coleneuramideWHO MedNet
Synonym  Source
MCC-257ChEMBL