Isochlortetracycline

Isochlortetracycline is an inactive alkaline degradation product of the broad-spectrum antibiotic chlortetracycline. This molecule appears to be a product of in vivo chlortetracycline metabolism with epimerization rates exceeding >50%, and high levels can be detected in the yolks of eggs from chickens exposed to this antibiotic. Isochlortetracycline is used as a reference standard in chromatographic analyses of chlortetracycline and its metabolic derivatives.Formal Name: (4S,4aS,6S,8aS)-6-[(1S)-7-chloro-1,3-dihydro-4-hydroxy-1-methyl-3-oxo-1-isobenzofuranyl]-4-(dimethylamino)-1,4,4a,5,6,7,8,8a-octahydro-3,8a-dihydroxy-1,8-dioxo-2-naphthalenecarboxamide. CAS Number: 514-53-4. Synonyms: 7-Chloroisotetracycline, Isoaureomycin. Molecular Formula: C22H23ClN2O8. Formula Weight: 478.9. Purity: >95%. Formulation: (Request formulation change), A solid. Solubility: DMF: soluble, DMSO: soluble, Ethanol: soluble, Methanol: soluble. SMILES: O=C([C@@](C(C(C(N)=O)=C(O)[C@H]1N(C)C)=O)(O)[C@@]1([H])C2)C[C@@]2([H])[C@]3(C)OC(C4=C3C(Cl)=CC=C4O)=O. InChi Code: InChI=1S/C22H23ClN2O8/c1-21(15-10(23)4-5-11(26)13(15)20(31)33-21)8-6-9-16(25(2)3)17(28)14(19(24)30)18(29)22(9,32)12(27)7-8/h4-5,8-9,16,26,28,32H,6-7H2,1-3H3,(H2,24,30)/t8-,9-,16-,21-,22-/m0/s1. InChi Key: GFSLIMZISCAANG-AXVXPIMKSA-N. Origin: Synthetic.