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CHEBI:113867 - N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-methoxybenzenesulfonamide

ChEBI IDCHEBI:113867
ChEBI NameN-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-methoxybenzenesulfonamide
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FormulaC24H33N3O6S
Net Charge0
Average Mass491.610
Monoisotopic Mass491.20901
SMILESCNC[C@@H]1Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2CC(=O)N([C@@H](C)CO)C[C@H]1C
InChIInChI=1S/C24H33N3O6S/c1-16-14-27(17(2)15-28)24(29)12-18-11-19(5-10-22(18)33-23(16)13-25-3)26-34(30,31)21-8-6-20(32-4)7-9-21/h5-11,16-17,23,25-26,28H,12-15H2,1-4H3/t16-,17+,23+/m1/s1
InChIKeyWHSSCNZRIKSNFR-DGGJZMOXSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-methoxybenzenesulfonamide (CHEBI:113867) is a sulfonamide (CHEBI:35358)
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