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CHEBI:126171 - N-[(3R,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-9-[[[(4-methoxyanilino)-oxomethyl]-methylamino]methyl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

ChEBI IDCHEBI:126171
ChEBI NameN-[(3R,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-9-[[[(4-methoxyanilino)-oxomethyl]-methylamino]methyl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide
Stars
Last Modified3 March 2016
DownloadsMolfile
FormulaC38H50N4O7
Net Charge0
Average Mass674.839
Monoisotopic Mass674.36795
SMILESCOc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N([C@H](C)CO)C[C@H]2C)cc1
InChIInChI=1S/C38H50N4O7/c1-26-23-42(27(2)25-43)37(45)33-22-31(39-36(44)21-29-12-7-6-8-13-29)16-19-34(33)49-28(3)11-9-10-20-48-35(26)24-41(4)38(46)40-30-14-17-32(47-5)18-15-30/h6-8,12-19,22,26-28,35,43H,9-11,20-21,23-25H2,1-5H3,(H,39,44)(H,40,46)/t26-,27-,28-,35+/m1/s1
InChIKeyQCMJPWQZARRNTL-GBJJYOARSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(3R,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-9-[[[(4-methoxyanilino)-oxomethyl]-methylamino]methyl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide (CHEBI:126171) is a azamacrocycle (CHEBI:52898)
N-[(3R,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-9-[[[(4-methoxyanilino)-oxomethyl]-methylamino]methyl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide (CHEBI:126171) is a lactam (CHEBI:24995)
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