1-[[(4S,5S)-8-[(3S)-3-hydroxybut-1-ynyl]-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-1-methyl-3-propan-2-ylurea

Properties Image Occurences in reactions MNX_ID MNXM341880 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C23H35N3O6S charge 0 mass 481.22466 reference chebi:96589 InChIKey VEFOSOMUCSIFLK-RYLXDESZSA-N InChI InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18-,21+/m0/s1 SMILES CC(C)NC(=O)N(C)C[C@H]1Oc2cc(C#C[C@H](C)O)ccc2S(=O)(=O)N([C@@H](C)CO)C[C@@H]1C

Parent-child relations graph

Deprecated MNXref IDs graph