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CHEBI:124221 - N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]methanesulfonamide

ChEBI IDCHEBI:124221
ChEBI NameN-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]methanesulfonamide
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DownloadsMolfile
FormulaC23H32N4O5S
Net Charge0
Average Mass476.599
Monoisotopic Mass476.20934
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ccc(NS(C)(=O)=O)cc2C1=O
InChIInChI=1S/C23H32N4O5S/c1-16-12-27(17(2)15-28)23(29)20-11-19(25-33(4,30)31)5-6-21(20)32-22(16)14-26(3)13-18-7-9-24-10-8-18/h5-11,16-17,22,25,28H,12-15H2,1-4H3/t16-,17+,22-/m0/s1
InChIKeyOLZDAYFSXQRXFW-JKSBSHDWSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]methanesulfonamide (CHEBI:124221) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-35663LINCS