Aclarubicin HCl

(Aclacinon, Aclaplastin, Aclarubicin hydrochloride, Aclacinomycin A hydrochloride)

Purity >90.0%

Aclarubicin is an anthracycline drug that is used in the treatment of cancer especially lung and tumor studies.

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Aclarubicin HCl Structural Descriptors:

IUPAC Name: methyl (1R,2R,4S)-4-[(2R,4S,5S,6S)-4-(dimethylamino)-5-[(2S,4S,5S, 6S)-4-hydroxy-6-methyl-5-[(2R, 6S)-6-methyl-5-oxooxan-2-yl]oxyoxan-2-yl]oxy-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate hydrochloride

InChIKey: KUSMIBXCRZTVML-PCCPLWKKSA-N

Canonical SMILES : CCC1(CC(C2=C(C1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C3=O)C=CC=C4O)OC5CC(C(C(O5) C)OC6CC(C(C(O6)C)OC7CCC(=O)C(O7)C)O)N(C)C)O.Cl

Isomeric SMILES: CC[C@]1(C[C@@H](C2=C([C@H]1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C3=O)C=CC=C4O)O [C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O[C@H]6C[C@@H]([C@@H]([C@@H](O6)C)O[C@ H]7CCC(=O)[C@@H](O7)C)O)N(C)C)O.Cl