(8S-cis)-8-Acetyl-10-((3-(cyclohexylamino)-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-5,12-naphthacenedione hydrochloride
[CAS# 79898-09-2]

Identification

• Name: (8S-cis)-8-Acetyl-10-((3-(cyclohexylamino)-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-5,12-naphthacenedione hydrochloride
• Synonyms: 9-Acetyl-7-[4-(Cyclohexylamino)-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-6,9,11-Trihydroxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione Hydrochloride; 9-Acetyl-7-[[4-(Cyclohexylamino)-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-6,9,11-Trihydroxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione Hydrochloride; 9-Acetyl-7-[4-(Cyclohexylamino)-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-6,9,11-Trihydroxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone Hydrochloride
• Molecular Formula: C₃₃H₄₀ClNO₁₀
• Molecular Weight: 646.13
• CAS Registry Number: 79898-09-2
• SMILES: [H+].C1=CC=C(OC)C6=C1C(=O)C5=C(O)C4=C(C(OC3OC(C(O)C(NC2CCCCC2)C3)C)CC(O)(C4)C(=O)C)C(=C5C6=O)O.[Cl-]
• InChI: 1S/C33H39NO10.ClH/c1-15-28(36)20(34-17-8-5-4-6-9-17)12-23(43-15)44-22-14-33(41,16(2)35)13-19-25(22)32(40)27-26(30(19)38)29(37)18-10-7-11-21(42-3)24(18)31(27)39;/h7,10-11,15,17,20,22-23,28,34,36,38,40-41H,4-6,8-9,12-14H2,1-3H3;1H
• InChIKey: RNGFHXJCATWISP-UHFFFAOYSA-N

Properties

• Boiling point: 813.4°C at 760 mmHg (Cal.)
• Flash point: 445.8°C (Cal.)