Tirilazad mesylate

Properties Image Occurences in reactions MNX_ID MNXM161663 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C39H56N6O5S charge 0 mass 720.40329 reference chebi:32233 InChIKey HPZOOQSXPMEJBV-ODCFVKFUSA-N InChI InChI=1S/C38H52N6O2.CH4O3S/c1-26-22-31-29-9-8-27-23-28(45)10-12-37(27,2)30(29)11-13-38(31,3)35(26)32(46)25-41-18-20-43(21-19-41)34-24-33(42-14-4-5-15-42)39-36(40-34)44-16-6-7-17-44;1-5(2,3)4/h10-12,23-24,26,29,31,35H,4-9,13-22,25H2,1-3H3;1H3,(H,2,3,4)/t26-,29-,31+,35-,37+,38+;/m1./s1 SMILES CS(=O)(=O)O.C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@H]1C(=O)CN1CCN(c2cc(N3CCCC3)nc(N3CCCC3)n2)CC1

Parent-child relations graph

Deprecated MNXref IDs graph