CHEBI:122546 - 1-[(4R,7R,8S)-5-[cyclohexyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propylurea

ChEBI IDCHEBI:122546
ChEBI Name1-[(4R,7R,8S)-5-[cyclohexyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propylurea
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DownloadsMolfile
FormulaC28H44N4O5
Net Charge0
Average Mass516.683
Monoisotopic Mass516.33117
SMILESCCCNC(=O)Nc1ccc2c(c1)C(=O)N(C)C[C@@H](OC)[C@H](C)CN(C(=O)C1CCCCC1)[C@H](C)CO2
InChIInChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20-,25-/m1/s1
InChIKeyVUNNIGMMXHQHNM-UMEGOILYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(4R,7R,8S)-5-[cyclohexyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propylurea (CHEBI:122546) is a azamacrocycle (CHEBI:52898)
1-[(4R,7R,8S)-5-[cyclohexyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propylurea (CHEBI:122546) is a lactam (CHEBI:24995)
Manual XrefsDatabases
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