CHEBI:126248 - N-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-oxanecarboxamide

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ChEBI Name N-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-oxanecarboxamide ChEBI ID CHEBI:126248 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C29H39N3O8S Net Charge 0 Average Mass 589.702 Monoisotopic Mass 589.24579 InChI InChI=1S/C29H39N3O8S/c1-19-16-32(20(2)18-33)29(35)24-6-5-7-25(30-28(34)21-12-14-39-15-13-21)27(24)40-26(19)17-31(3)41(36,37)23-10-8-22(38-4)9-11-23/h5-11,19-21,26,33H,12-18H2,1-4H3,(H,30,34)/t19-,20-,26-/m1/s1 InChIKey KUMTZIUPXZKNDA-XMERXJNXSA-N SMILES C[C@@H]1CN(C(=O)C2=C(C(=CC=C2)NC(=O)C3CCOCC3)O[C@@H]1CN(C)S(=O)(=O)C4=CC=C(C=C4)OC)[C@H](C)CO ChEBI Ontology Outgoing N-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-oxanecarboxamide (CHEBI:126248) is a sulfonamide (CHEBI:35358) Manual Xref Database LSM-37814 LINCS View more database links