4-Epidoxycycline

4-Epidoxycycline is the 4-epimer hepatic metabolite of the antibiotic doxycycline (Cay-14422). Unlike doxycycline, 4-epidoxycycline lacks antibiotic activity, therefore, it may not induce the intestinal inflammation in mice associated with doxycycline use. It is an alternative to doxycycline to inactivate the transactivator protein tTA or activate the reverse transactivator rtTA protein in Tet-Off- and Tet-On-based gene expression systems in vitro and in mice.Formal Name: (4R,4aR,5S,5aR,6R,12aS)-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide. CAS Number: 6543-77-7. Synonyms: 4-ED. Molecular Formula: C22H24N2O8. Formula Weight: 444.4. Purity: >70%. Formulation: (Request formulation change), A solid. Solubility: DMSO: slightly soluble, Methanol: slightly soluble. SMILES: OC1=C2C([C@H](C)[C@]3([H])C(C2=O)=C(O)[C@@]4(O)[C@@]([C@@H](N(C)C)C(O)=C(C(N)=O)C4=O)([H])[C@H]3O)=CC=C1. InChi Code: InChI=1S/C22H24N2O8/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29/h4-7,10,14-15,17,25,27-29,32H,1-3H3,(H2,23,31)/t7-,10+,14+,15+,17-,22-/m0/s1. InChi Key: JBIWCJUYHHGXTC-NLJUDYQYSA-N.