Ruboxyl
[CAS# 83138-78-7]

Identification

• Name: Ruboxyl
• Synonyms: (7S,9S)-7-[(2R,4S,5S,6S)-4-Amino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-6,9,11-Trihydroxy-9-[N-[(1-Hydroxy-2,2,6,6-Tetramethyl-4-Piperidylidene)Amino]-C-Methyl-Carbonimidoyl]-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione Hydrochloride; (7S,9S)-7-[[(2R,4S,5S,6S)-4-Amino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-6,9,11-Trihydroxy-9-[(1E)-1-[(1-Hydroxy-2,2,6,6-Tetramethyl-4-Piperidinylidene)Hydrazono]Ethyl]-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione Hydrochloride; (7S,9S)-7-[(2R,4S,5S,6S)-4-Amino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-6,9,11-Trihydroxy-9-[N-[(1-Hydroxy-2,2,6,6-Tetramethyl-4-Piperidylidene)Amino]-C-Methyl-Carbonimidoyl]-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone Hydrochloride
• Molecular Formula: C₃₆H₄₇ClN₄O₁₀
• Molecular Weight: 731.24
• CAS Registry Number: 83138-78-7
• SMILES: [C@]2(O)(C[C@H](O[C@@H]1O[C@H]([C@@H](O)[C@@H](N)C1)C)C3=C(C2)C(=C4C(=C3O)C(=O)C5=C(C4=O)C=CC=C5OC)O)/C(=N/N=C6CC(N(O)C(C6)(C)C)(C)C)C.[H+].[Cl-]
• InChI: 1S/C36H46N4O10.ClH/c1-16-29(41)21(37)11-24(49-16)50-23-15-36(46,17(2)38-39-18-12-34(3,4)40(47)35(5,6)13-18)14-20-26(23)33(45)28-27(31(20)43)30(42)19-9-8-10-22(48-7)25(19)32(28)44;/h8-10,16,21,23-24,29,41,43,45-47H,11-15,37H2,1-7H3;1H/b38-17+;/t16-,21-,23-,24-,29+,36-;/m0./s1
• InChIKey: GYPCWHHQAVLMKO-XXKQIVDLSA-N