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CHEBI:123704 - N-[(2R,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-1-methyl-4-imidazolesulfonamide

ChEBI IDCHEBI:123704
ChEBI NameN-[(2R,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-1-methyl-4-imidazolesulfonamide
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DownloadsMolfile
FormulaC24H35N5O5S
Net Charge0
Average Mass505.641
Monoisotopic Mass505.23589
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2O[C@H]1CN(C)CC1CC1
InChIInChI=1S/C24H35N5O5S/c1-16-10-29(17(2)14-30)24(31)20-9-19(26-35(32,33)23-13-28(4)15-25-23)7-8-21(20)34-22(16)12-27(3)11-18-5-6-18/h7-9,13,15-18,22,26,30H,5-6,10-12,14H2,1-4H3/t16-,17+,22+/m1/s1
InChIKeyKTPUHGRRTQXBGV-JLHGSKIFSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-1-methyl-4-imidazolesulfonamide (CHEBI:123704) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-35146LINCS