3-[[(Undecyloxy)imino]methyl]rifamycin
[CAS# 41776-59-4]

Identification

• Name: 3-[[(Undecyloxy)imino]methyl]rifamycin
• Synonyms: Aids-009627; Aids009627; 2,7-(Epoxypentadeca(1,11,13)Trienimino)Naphtho(2,1-B)Furan-1,11(2H)-Dione, 3-Formyl-5,6,9,17,19,21-Hexahydroxy-23-Methoxy-2,4,12,16,18,20,22-Heptamethyl-, 21-Acetate, O-Undecyloxime
• Molecular Formula: C₄₉H₇₀N₂O₁₃
• Molecular Weight: 895.10
• CAS Registry Number: 41776-59-4
• SMILES: [C@H]1([C@H](O)[C@@H]([C@@H](O)[C@@H](C)\C=C\C=C(C(=O)NC4=C(O)C3=C(C2=C(O[C@](O/C=C/[C@H](OC)[C@H]([C@H]1OC(=O)C)C)(C2=O)C)C(=C3O)C)C(=O)\C4=C\NOCCCCCCCCCCC)\C)C)C
• InChI: 1S/C49H70N2O13/c1-11-12-13-14-15-16-17-18-19-24-62-50-26-34-39-44(57)37-36(43(34)56)38-46(32(7)42(37)55)64-49(9,47(38)58)61-25-23-35(60-10)29(4)45(63-33(8)52)31(6)41(54)30(5)40(53)27(2)21-20-22-28(3)48(59)51-39/h20-23,25-27,29-31,35,40-41,45,50,53-55,57H,11-19,24H2,1-10H3,(H,51,59)/b21-20+,25-23+,28-22-,34-26+/t27-,29+,30+,31+,35-,40-,41+,45+,49-/m0/s1
• InChIKey: SPPOTEBICWCPSU-GPKRDAAKSA-N