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CHEBI:95802 - N-[[(8S,9R)-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-methylphenyl) ester

ChEBI IDCHEBI:95802
ChEBI NameN-[[(8S,9R)-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-methylphenyl) ester
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DownloadsMolfile
FormulaC24H35N5O5
Net Charge0
Average Mass473.574
Monoisotopic Mass473.26382
SMILESCc1ccc(OC(=O)N(C)C[C@@H]2OCc3cn(nn3)CCCC(=O)N([C@@H](C)CO)C[C@@H]2C)cc1
InChIInChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22-/m0/s1
InChIKeyVOGIWUFDXLFNKS-IPJJNNNSSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(8S,9R)-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-methylphenyl) ester (CHEBI:95802) is a azamacrocycle (CHEBI:52898)
N-[[(8S,9R)-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-methylphenyl) ester (CHEBI:95802) is a lactam (CHEBI:24995)
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