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CHEBI:96987 - N-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methylcarbamic acid (4-methoxyphenyl) ester

ChEBI IDCHEBI:96987
ChEBI NameN-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methylcarbamic acid (4-methoxyphenyl) ester
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DownloadsMolfile
FormulaC24H35N5O6
Net Charge0
Average Mass489.573
Monoisotopic Mass489.25873
SMILESCOc1ccc(OC(=O)N(C)C[C@H]2OCc3cn(nn3)CCCC(=O)N([C@@H](C)CO)C[C@H]2C)cc1
InChIInChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22-/m1/s1
InChIKeyIKCPXJXAZOQLMC-KGVIQGDOSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methylcarbamic acid (4-methoxyphenyl) ester (CHEBI:96987) is a azamacrocycle (CHEBI:52898)
N-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methylcarbamic acid (4-methoxyphenyl) ester (CHEBI:96987) is a lactam (CHEBI:24995)
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