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CHEBI:124351 - N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide

ChEBI IDCHEBI:124351
ChEBI NameN-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide
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DownloadsMolfile
FormulaC23H32N4O5S
Net Charge0
Average Mass476.599
Monoisotopic Mass476.20934
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)c2cccc(NS(C)(=O)=O)c2O[C@H]1CN(C)Cc1ccncc1
InChIInChI=1S/C23H32N4O5S/c1-16-12-27(17(2)15-28)23(29)19-6-5-7-20(25-33(4,30)31)22(19)32-21(16)14-26(3)13-18-8-10-24-11-9-18/h5-11,16-17,21,25,28H,12-15H2,1-4H3/t16-,17-,21+/m1/s1
InChIKeyXSVWXWXXBTWSOZ-LZJOCLMNSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide (CHEBI:124351) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-35793LINCS