7-[4-(Bis(Pyridin-3-Ylmethyl)Amino)-5-Hydroxy-6-Methyloxan-2-Yl]Oxy-6,9,11-Trihydroxy-9-(2-Hydroxyacetyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione
[CAS# 145785-64-4]

Identification

• Name: 7-[4-(Bis(Pyridin-3-Ylmethyl)Amino)-5-Hydroxy-6-Methyloxan-2-Yl]Oxy-6,9,11-Trihydroxy-9-(2-Hydroxyacetyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione
• Synonyms: 7-[4-(Bis(3-Pyridylmethyl)Amino)-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-6,9,11-Trihydroxy-9-(2-Hydroxyacetyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 7-[[4-(Bis(3-Pyridylmethyl)Amino)-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-6,9,11-Trihydroxy-9-(2-Hydroxy-1-Oxoethyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 7-[4-(Bis(3-Pyridylmethyl)Amino)-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-9-Glycoloyl-6,9,11-Trihydroxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone
• Molecular Formula: C₃₉H₃₉N₃O₁₁
• Molecular Weight: 725.75
• CAS Registry Number: 145785-64-4
• SMILES: C7=C6C(=O)C1=C(C(=C2C(=C1O)CC(O)(CC2OC5OC(C(O)C(N(CC3=CC=CN=C3)CC4=CC=CN=C4)C5)C)C(=O)CO)O)C(=O)C6=C(OC)C=C7
• InChI: 1S/C39H39N3O11/c1-20-34(45)25(42(17-21-6-4-10-40-15-21)18-22-7-5-11-41-16-22)12-29(52-20)53-27-14-39(50,28(44)19-43)13-24-31(27)38(49)33-32(36(24)47)35(46)23-8-3-9-26(51-2)30(23)37(33)48/h3-11,15-16,20,25,27,29,34,43,45,47,49-50H,12-14,17-19H2,1-2H3
• InChIKey: BCHRZIGRQLSNRO-UHFFFAOYSA-N

Properties

• Density: 1.534g/cm³ (Cal.)
• Boiling point: 939.564°C at 760 mmHg (Cal.)
• Flash point: 522.029°C (Cal.)