For research use only. Not for therapeutic Use.
Doxorubicinol hydrochloride（Cat No.:R034089）is the major active metabolite of doxorubicin, formed via enzymatic reduction of its carbonyl group. It retains the anthracycline core structure and exhibits cytotoxic activity, though typically with reduced potency compared to the parent compound. Doxorubicinol is particularly noted for its role in cardiotoxicity, making it a key analyte in pharmacokinetic and toxicology studies. It intercalates DNA and inhibits topoisomerase II, impairing DNA replication and transcription. Supplied as a hydrochloride salt for stability and solubility, it is intended for use in cancer biology and drug metabolism research.
| CAS Number | 63950-05-0 |
| Synonyms | (7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-9-[(1S)-1,2-dihydroxyethyl]-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride |
| Molecular Formula | C27H32ClNO11 |
| Purity | ≥95% |
| IUPAC Name | (7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-9-[(1S)-1,2-dihydroxyethyl]-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride |
| InChI | InChI=1S/C27H31NO11.ClH/c1-10-22(31)13(28)6-17(38-10)39-15-8-27(36,16(30)9-29)7-12-19(15)26(35)21-20(24(12)33)23(32)11-4-3-5-14(37-2)18(11)25(21)34;/h3-5,10,13,15-17,22,29-31,33,35-36H,6-9,28H2,1-2H3;1H/t10-,13-,15-,16-,17-,22+,27-;/m0./s1 |
| InChIKey | ORLHIGGRLIJIIM-PNOIAXSSSA-N |
| SMILES | C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)([C@H](CO)O)O)N)O.Cl |
| Chemistry Calculators | Dilution Calculator In vivo Formulation Calculator Molarity Calculator Molecular Weight Calculator Reconstitution Calculator |
