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CHEBI:96872 - 2-fluoro-N-[[(8S,9S)-6-[(2R)-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-methylbenzenesulfonamide

ChEBI IDCHEBI:96872
ChEBI Name2-fluoro-N-[[(8S,9S)-6-[(2R)-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-methylbenzenesulfonamide
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DownloadsMolfile
FormulaC22H32FN5O5S
Net Charge0
Average Mass497.593
Monoisotopic Mass497.21082
SMILESC[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cn(nn2)CCCC1=O
InChIInChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17+,20+/m0/s1
InChIKeyJYOVEVCXPRGJRX-SQGPQFPESA-N
ChEBI Ontology
Outgoing Relation(s)
2-fluoro-N-[[(8S,9S)-6-[(2R)-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-methylbenzenesulfonamide (CHEBI:96872) is a azamacrocycle (CHEBI:52898)
2-fluoro-N-[[(8S,9S)-6-[(2R)-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-methylbenzenesulfonamide (CHEBI:96872) is a lactam (CHEBI:24995)
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