CHEBI:108921 - N-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-1-methyl-4-imidazolesulfonamide

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ChEBI Name N-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-1-methyl-4-imidazolesulfonamide
ChEBI ID CHEBI:108921
Stars This entity has been manually annotated by a third party.
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Formula C21H31N5O5S
Net Charge 0
Average Mass 465.568
Monoisotopic Mass 465.20459
InChI InChI=1S/C21H31N5O5S/c1-14-10-26(15(2)12-27)21(28)8-16-7-17(5-6-18(16)31-19(14)9-22-3)24-32(29,30)20-11-25(4)13-23-20/h5-7,11,13-15,19,22,24,27H,8-10,12H2,1-4H3/t14-,15-,19-/m1/s1
InChIKey CHBVISFKEYYRMC-SPYBWZPUSA-N
SMILES C[C@@H]1CN(C(=O)CC2=C(C=CC(=C2)NS(=O)(=O)C3=CN(C=N3)C)O[C@@H]1CNC)[C@H](C)CO
ChEBI Ontology
Outgoing N-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-1-methyl-4-imidazolesulfonamide (CHEBI:108921) is a sulfonamide (CHEBI:35358)
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