Methyl 4-[4-Dimethylamino-5-[4-Hydroxy-6-Methyl-5-(6-Methyl-5-Oxooxan-2-Yl)Oxyoxan-2-Yl]Oxy-6-Methyloxan-2-Yl]Oxy-2-Ethyl-2,5,7,9-Tetrahydroxy-6,11-Dioxo-3,4-Dihydro-1H-Tetracene-1-Carboxylate
[CAS# 79127-36-9]

Identification

• Name: Methyl 4-[4-Dimethylamino-5-[4-Hydroxy-6-Methyl-5-(6-Methyl-5-Oxooxan-2-Yl)Oxyoxan-2-Yl]Oxy-6-Methyloxan-2-Yl]Oxy-2-Ethyl-2,5,7,9-Tetrahydroxy-6,11-Dioxo-3,4-Dihydro-1H-Tetracene-1-Carboxylate
• Synonyms: Methyl 4-[4-Dimethylamino-5-[4-Hydroxy-6-Methyl-5-(6-Methyl-5-Oxo-Tetrahydropyran-2-Yl)Oxy-Tetrahydropyran-2-Yl]Oxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-2-Ethyl-2,5,7,9-Tetrahydroxy-6,11-Dioxo-3,4-Dihydro-1H-Tetracene-1-Carboxylate; 4-[[4-Dimethylamino-5-[[4-Hydroxy-6-Methyl-5-[(6-Methyl-5-Oxo-2-Tetrahydropyranyl)Oxy]-2-Tetrahydropyranyl]Oxy]-6-Methyl-2-Tetrahydropyranyl]Oxy]-2-Ethyl-2,5,7,9-Tetrahydroxy-6,11-Dioxo-3,4-Dihydro-1H-Tetracene-1-Carboxylic Acid Methyl Ester; 4-[4-Dimethylamino-5-[4-Hydroxy-5-(5-Keto-6-Methyl-Tetrahydropyran-2-Yl)Oxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-2-Ethyl-2,5,7,9-Tetrahydroxy-6,11-Diketo-3,4-Dihydro-1H-Tetracene-1-Carboxylic Acid Methyl Ester
• Molecular Formula: C₄₂H₅₃NO₁₆
• Molecular Weight: 827.88
• CAS Registry Number: 79127-36-9
• SMILES: C1=C6C(=C(O)C2=C1C(C(O)(CC2OC5OC(C(OC4OC(C(OC3OC(C(=O)CC3)C)C(O)C4)C)C(N(C)C)C5)C)CC)C(OC)=O)C(=O)C7=C(C6=O)C=C(O)C=C7O
• InChI: 1S/C42H53NO16/c1-8-42(52)16-28(33-21(35(42)41(51)53-7)13-23-34(38(33)50)37(49)32-22(36(23)48)11-20(44)12-26(32)46)57-30-14-24(43(5)6)39(18(3)55-30)59-31-15-27(47)40(19(4)56-31)58-29-10-9-25(45)17(2)54-29/h11-13,17-19,24,27-31,35,39-40,44,46-47,50,52H,8-10,14-16H2,1-7H3
• InChIKey: OPLSIDPSRWNQIH-UHFFFAOYSA-N

Properties

• Density: 1.461g/cm³ (Cal.)
• Boiling point: 942.612°C at 760 mmHg (Cal.)
• Flash point: 523.873°C (Cal.)