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CHEBI:122602 - 1-[(5S,6S,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-propylurea

ChEBI IDCHEBI:122602
ChEBI Name1-[(5S,6S,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-propylurea
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DownloadsMolfile
FormulaC23H36N4O5
Net Charge0
Average Mass448.564
Monoisotopic Mass448.26857
SMILESCCCNC(=O)Nc1ccc2c(c1)OC[C@@H](C)N(C(C)=O)C[C@H](C)[C@H](OC)CN(C)C2=O
InChIInChI=1S/C23H36N4O5/c1-7-10-24-23(30)25-18-8-9-19-20(11-18)32-14-16(3)27(17(4)28)12-15(2)21(31-6)13-26(5)22(19)29/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H2,24,25,30)/t15-,16+,21+/m0/s1
InChIKeyFGFJNWQPGUBCRY-GCKMJXCFSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(5S,6S,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-propylurea (CHEBI:122602) is a azamacrocycle (CHEBI:52898)
1-[(5S,6S,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-propylurea (CHEBI:122602) is a lactam (CHEBI:24995)
Manual XrefsDatabases
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