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CHEBI:124513 - N-[(2S,3R)-2-[(dimethylamino)methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-fluorobenzenesulfonamide

ChEBI IDCHEBI:124513
ChEBI NameN-[(2S,3R)-2-[(dimethylamino)methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-fluorobenzenesulfonamide
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DownloadsMolfile
FormulaC24H32FN3O5S
Net Charge0
Average Mass493.601
Monoisotopic Mass493.20467
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)Cc2cc(NS(=O)(=O)c3ccc(F)cc3)ccc2O[C@@H]1CN(C)C
InChIInChI=1S/C24H32FN3O5S/c1-16-13-28(17(2)15-29)24(30)12-18-11-20(7-10-22(18)33-23(16)14-27(3)4)26-34(31,32)21-8-5-19(25)6-9-21/h5-11,16-17,23,26,29H,12-15H2,1-4H3/t16-,17-,23-/m1/s1
InChIKeyVCRKNKMPQDEVAF-SEPYTNNBSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R)-2-[(dimethylamino)methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-fluorobenzenesulfonamide (CHEBI:124513) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-35955LINCS