(2S,12Z,14E,16S,17S,18R,19R,20R,21S,22R,23S,24E)-21-(Acetyloxy)-5,6,9,17,19-Pentahydroxy-23-Methoxy-2,4,12,16,18,20,22-Heptamethyl-8-[(E)-[(4-Methyl-1-Piperazinyl)Imino]Meth Yl]-2,7-(Epoxy[1,11,13]Pentadecatrienoimino)Naphtho[2,1-b]Furan-1,11(2H)-Dione Sodium Salt (1:1)
[CAS# 38776-75-9]

Identification

• Name: (2S,12Z,14E,16S,17S,18R,19R,20R,21S,22R,23S,24E)-21-(Acetyloxy)-5,6,9,17,19-Pentahydroxy-23-Methoxy-2,4,12,16,18,20,22-Heptamethyl-8-[(E)-[(4-Methyl-1-Piperazinyl)Imino]Meth Yl]-2,7-(Epoxy[1,11,13]Pentadecatrienoimino)Naphtho[2,1-b]Furan-1,11(2H)-Dione Sodium Salt (1:1)
• Synonyms: RIFAMPICIN SODIUM
• Molecular Formula: C₄₃H₅₈N₄NaO₁₂
• Molecular Weight: 845.93
• CAS Registry Number: 38776-75-9
• SMILES: [Na+].CN1CCN(CC1)/N=C/c2c(O)c3c5C(=O)[C@@]4(C)O/C=C/[C@H](OC)[C@@H](C)[C@@H](OC(C)=O)[C@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@@H](C)\C=C\C=C(\C)C(=O)Nc2c(O)c3c(O)c(C)c5O4
• InChI: 1S/C43H58N4O12.Na/c1-21-12-11-13-22(2)42(55)45-33-28(20-44-47-17-15-46(9)16-18-47)37(52)30-31(38(33)53)36(51)26(6)40-32(30)41(54)43(8,59-40)57-19-14-29(56-10)23(3)39(58-27(7)48)25(5)35(50)24(4)34(21)49;/h11-14,19-21,23-25,29,34-35,39,49-53H,15-18H2,1-10H3,(H,45,55);/q;+1/b12-11+,19-14+,22-13-,44-20+;/t21-,23+,24+,25+,29-,34-,35+,39+,43-;/m0./s1
• InChIKey: PPGHYTPFGILTSZ-PPJQWWMSSA-N