3-(((pentyloxy)imino)methyl)-Rifamycin
[CAS# 38128-84-6]

Identification

• Name: 3-(((pentyloxy)imino)methyl)-Rifamycin
• Synonyms: 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-Pentyloxime; 3-Formylrifamycin Sv O-Pentyloxime; Brn 5418326
• Molecular Formula: C₄₃H₅₈N₂O₁₃
• Molecular Weight: 810.94
• CAS Registry Number: 38128-84-6
• 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\NOCCCCC)\C)C)C
• InChI: 1S/C43H58N2O13/c1-11-12-13-18-56-44-20-28-33-38(51)31-30(37(28)50)32-40(26(7)36(31)49)58-43(9,41(32)52)55-19-17-29(54-10)23(4)39(57-27(8)46)25(6)35(48)24(5)34(47)21(2)15-14-16-22(3)42(53)45-33/h14-17,19-21,23-25,29,34-35,39,44,47-49,51H,11-13,18H2,1-10H3,(H,45,53)/b15-14+,19-17+,22-16-,28-20+/t21-,23+,24+,25+,29-,34-,35+,39+,43-/m0/s1
• InChIKey: MMUMGELSGJQELW-PNCFFQGBSA-N