Benexate hydrochloride betadex (JAN)

Properties Image Occurences in reactions MNX_ID MNXM16277 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C65H98ClN3O39 charge 0 mass 1579.5466 reference keggD:D02452 InChIKey GXDHQWGMXDZDKO-QEJSXMIFSA-N InChI InChI=1S/C42H70O35.C23H27N3O4.ClH/c43-1-8-29-15(50)22(57)36(64-8)72-30-9(2-44)66-38(24(59)17(30)52)74-32-11(4-46)68-40(26(61)19(32)54)76-34-13(6-48)70-42(28(63)21(34)56)77-35-14(7-49)69-41(27(62)20(35)55)75-33-12(5-47)67-39(25(60)18(33)53)73-31-10(3-45)65-37(71-29)23(58)16(31)51;24-23(25)26-14-16-10-12-18(13-11-16)21(27)30-20-9-5-4-8-19(20)22(28)29-15-17-6-2-1-3-7-17;/h8-63H,1-7H2;1-9,16,18H,10-15H2,(H4,24,25,26);1H/t8-,9-,10-,11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-;;/m1../s1 SMILES Cl.N=C(N)NCC1CCC(C(=O)Oc2ccccc2C(=O)OCc2ccccc2)CC1.OC[C@H]1O[C@@H]2O[C@@H]3[C@@H](CO)O[C@H](O[C@@H]4[C@@H](CO)O[C@H](O[C@@H]5[C@@H](CO)O[C@H](O[C@@H]6[C@@H](CO)O[C@H](O[C@@H]7[C@@H](CO)O[C@H](O[C@@H]8[C@@H](CO)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O

Parent-child relations graph

Deprecated MNXref IDs graph