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CHEBI:96142 - N-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N,2-dimethylbenzenesulfonamide

ChEBI IDCHEBI:96142
ChEBI NameN-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N,2-dimethylbenzenesulfonamide
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DownloadsMolfile
FormulaC23H35N5O5S
Net Charge0
Average Mass493.630
Monoisotopic Mass493.23589
SMILESCc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N([C@H](C)CO)C[C@H]1C
InChIInChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)13-27(19(3)15-29)23(30)10-7-11-28-20(16-33-21)12-24-25-28/h5-6,8-9,12,18-19,21,29H,7,10-11,13-16H2,1-4H3/t18-,19-,21+/m1/s1
InChIKeyPKTOTAWSKYPRKJ-SBHAEUEKSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N,2-dimethylbenzenesulfonamide (CHEBI:96142) is a azamacrocycle (CHEBI:52898)
N-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N,2-dimethylbenzenesulfonamide (CHEBI:96142) is a lactam (CHEBI:24995)
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