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CHEBI:115136 - 1-(3,5-dimethyl-4-isoxazolyl)-3-[(5R,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-propyl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea

ChEBI IDCHEBI:115136
ChEBI Name1-(3,5-dimethyl-4-isoxazolyl)-3-[(5R,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-propyl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
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DownloadsMolfile
FormulaC26H39N5O5
Net Charge0
Average Mass501.628
Monoisotopic Mass501.29512
SMILESCCCN1C[C@H](C)[C@@H](OC)CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@H]1C
InChIInChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17+,23-/m0/s1
InChIKeyUPIUFFQPNYDCFX-MFEFFIJZSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(3,5-dimethyl-4-isoxazolyl)-3-[(5R,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-propyl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea (CHEBI:115136) is a azamacrocycle (CHEBI:52898)
1-(3,5-dimethyl-4-isoxazolyl)-3-[(5R,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-propyl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea (CHEBI:115136) is a lactam (CHEBI:24995)
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