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CHEBI:111585 - N-[(2S,3S)-2-[[(4-chlorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclohexanecarboxamide

ChEBI IDCHEBI:111585
ChEBI NameN-[(2S,3S)-2-[[(4-chlorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclohexanecarboxamide
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DownloadsMolfile
FormulaC29H38ClN3O6S
Net Charge0
Average Mass592.158
Monoisotopic Mass591.21698
SMILESC[C@H]1CN([C@@H](C)CO)C(=O)c2cccc(NC(=O)C3CCCCC3)c2O[C@@H]1CN(C)S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C29H38ClN3O6S/c1-19-16-33(20(2)18-34)29(36)24-10-7-11-25(31-28(35)21-8-5-4-6-9-21)27(24)39-26(19)17-32(3)40(37,38)23-14-12-22(30)13-15-23/h7,10-15,19-21,26,34H,4-6,8-9,16-18H2,1-3H3,(H,31,35)/t19-,20-,26+/m0/s1
InChIKeyODSKXFDDLKDNDM-CUVVAGTFSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3S)-2-[[(4-chlorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclohexanecarboxamide (CHEBI:111585) is a sulfonamide (CHEBI:35358)
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