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CHEBI:124246 - 1-[[(2S,3R)-9-(benzenesulfonamido)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-1-methyl-3-propan-2-ylurea

ChEBI IDCHEBI:124246
ChEBI Name1-[[(2S,3R)-9-(benzenesulfonamido)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-1-methyl-3-propan-2-ylurea
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DownloadsMolfile
FormulaC27H38N4O6S
Net Charge0
Average Mass546.690
Monoisotopic Mass546.25121
SMILESCC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NS(=O)(=O)c3ccccc3)cc2CC(=O)N([C@H](C)CO)C[C@H]1C
InChIInChI=1S/C27H38N4O6S/c1-18(2)28-27(34)30(5)16-25-19(3)15-31(20(4)17-32)26(33)14-21-13-22(11-12-24(21)37-25)29-38(35,36)23-9-7-6-8-10-23/h6-13,18-20,25,29,32H,14-17H2,1-5H3,(H,28,34)/t19-,20-,25-/m1/s1
InChIKeyLNIIROWVVFKABQ-UMEGOILYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[[(2S,3R)-9-(benzenesulfonamido)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-1-methyl-3-propan-2-ylurea (CHEBI:124246) is a sulfonamide (CHEBI:35358)
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