CHEBI:96155 - N-[[(4R,5S)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-8-(3-methylbut-1-ynyl)-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide

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ChEBI Name N-[[(4R,5S)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-8-(3-methylbut-1-ynyl)-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide ChEBI ID CHEBI:96155 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C24H34N4O6S2 Net Charge 0 Average Mass 538.683 Monoisotopic Mass 538.19198 InChI InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19-,22-/m1/s1 InChIKey MFJAJISBYJYJML-WOIUINJBSA-N SMILES C[C@@H]1CN(S(=O)(=O)C2=C(C=C(C=C2)C#CC(C)C)O[C@@H]1CN(C)S(=O)(=O)C3=CN(C=N3)C)[C@H](C)CO ChEBI Ontology Outgoing N-[[(4R,5S)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-8-(3-methylbut-1-ynyl)-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide (CHEBI:96155) is a aromatic ether (CHEBI:35618) Manual Xref Database LSM-7534 LINCS View more database links