Rifamexil
[CAS# 113102-19-5]

Identification

• Name: Rifamexil
• Synonyms: D02552; Rifamexil (Usan); 9,4-(Epoxy[1,11,13]Pentadecatrienoimino)Furo[2',3':7,8]Naphtho[1,2-D]Thiazole-10,26(9H)-Dione, 16-(Acetyloxy)-2-(Diethylamino)-5,6,18,20-Tetrahydroxy-14-Methoxy-7,9,15,17,19,21,25-Heptamethyl-, (9S,14S,15R,16S,17R,18R,19R,20S,21S)-
• Molecular Formula: C₄₂H₅₅N₃O₁₁S
• Molecular Weight: 809.97
• CAS Registry Number: 113102-19-5
• SMILES: [C@]14(C(C2=C(O1)C(=C(C3=C2C5=C(C(=C3O)NC(C(=C\C=C\[C@@H]([C@H](O)[C@H]([C@H]([C@H]([C@@H]([C@@H]([C@H](/C=C/O4)OC)C)OC(C)=O)C)O)C)C)/C)=O)SC(=N5)N(CC)CC)O)C)=O)C
• InChI: 1S/C42H55N3O11S/c1-12-45(13-2)41-44-30-27-28-34(49)24(8)37-29(27)39(51)42(10,56-37)54-18-17-26(53-11)21(5)36(55-25(9)46)23(7)33(48)22(6)32(47)19(3)15-14-16-20(4)40(52)43-31(35(28)50)38(30)57-41/h14-19,21-23,26,32-33,36,47-50H,12-13H2,1-11H3,(H,43,52)/b15-14+,18-17+,20-16-/t19-,21+,22+,23+,26-,32-,33+,36+,42-/m0/s1
• InChIKey: QTLQVMGAXZJADU-ZRWMMNBYSA-N

Properties

• Density: 1.344g/cm³ (Cal.)