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CHEBI:126320 - 1-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea

ChEBI IDCHEBI:126320
ChEBI Name1-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea
Stars
DownloadsMolfile
FormulaC24H33F3N6O4
Net Charge0
Average Mass526.560
Monoisotopic Mass526.25154
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)CCCn2nncc2CO[C@H]1CN(C)C(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)5-4-10-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-8-6-18(7-9-19)24(25,26)27/h6-9,11,16-17,21,34H,4-5,10,12-15H2,1-3H3,(H,29,36)/t16-,17+,21+/m1/s1
InChIKeyMHRPTBSVTMBPJG-WWMYMODYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea (CHEBI:126320) is a azamacrocycle (CHEBI:52898)
1-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea (CHEBI:126320) is a lactam (CHEBI:24995)
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