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CHEBI:111879 - 1-[(5S,6R,9R)-8-acetyl-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(2-chlorophenyl)urea

ChEBI IDCHEBI:111879
ChEBI Name1-[(5S,6R,9R)-8-acetyl-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(2-chlorophenyl)urea
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DownloadsMolfile
FormulaC26H33ClN4O5
Net Charge0
Average Mass517.026
Monoisotopic Mass516.21395
SMILESCO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3Cl)cc2OC[C@@H](C)N(C(C)=O)C[C@H]1C
InChIInChI=1S/C26H33ClN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-19(28-26(34)29-22-9-7-6-8-21(22)27)10-11-20(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24-/m1/s1
InChIKeyVXDVHPQBGXHDCU-HOZJOUCCSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(5S,6R,9R)-8-acetyl-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(2-chlorophenyl)urea (CHEBI:111879) is a azamacrocycle (CHEBI:52898)
1-[(5S,6R,9R)-8-acetyl-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(2-chlorophenyl)urea (CHEBI:111879) is a lactam (CHEBI:24995)
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