CHEBI:96882 - 2-fluoro-N-[[(8S,9S)-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-methylbenzenesulfonamide

ChEBI IDCHEBI:96882
ChEBI Name2-fluoro-N-[[(8S,9S)-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-methylbenzenesulfonamide
Stars
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)OCc2cnnn2CCCC1=O
InChIInChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)9-6-10-28-18(11-24-25-28)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,11,16-17,20,29H,6,9-10,12-15H2,1-3H3/t16-,17+,20+/m0/s1
InChIKeyMFABSAUNVKQXNQ-SQGPQFPESA-N
ChEBI Ontology
Outgoing Relation(s)
2-fluoro-N-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methylbenzenesulfonamide (CHEBI:96882) is a azamacrocycle (CHEBI:52898)
2-fluoro-N-[[(8S,9S)-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-methylbenzenesulfonamide (CHEBI:96882) is a lactam (CHEBI:24995)
Manual XrefsDatabases
LSM-8261LINCS