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CHEBI:96869 - 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]-4-methoxy-N-methylbenzenesulfonamide

ChEBI IDCHEBI:96869
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]-4-methoxy-N-methylbenzenesulfonamide
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DownloadsMolfile
FormulaC23H35N5O6S
Net Charge0
Average Mass509.629
Monoisotopic Mass509.23080
SMILESCOc1ccc(S(=O)(=O)N(C)C[C@@H]2OCc3cn(nn3)CCCC(=O)N([C@@H](C)CO)C[C@@H]2C)cc1
InChIInChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22-/m0/s1
InChIKeyAWVASGRLDZTAAI-SPEDKVCISA-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]-4-methoxy-N-methylbenzenesulfonamide (CHEBI:96869) 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]-4-methoxy-N-methylbenzenesulfonamide (CHEBI:96869) is a lactam (CHEBI:24995)
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