9-Acetyl-4,6,9,11-Tetrahydroxy-7-[[2-(2-Hydroxypropyl)-4,10-Dimethyl-4,6A,7,8,10,10alpha-Hexahydropyrano[5,4-d][1,3,6]Dioxazocin-8-Yl]Oxy]-8,10-Dihydro-7H-Tetracene-5,12-Dione
[CAS# 108147-17-7]

Identification

• Name: 9-Acetyl-4,6,9,11-Tetrahydroxy-7-[[2-(2-Hydroxypropyl)-4,10-Dimethyl-4,6A,7,8,10,10alpha-Hexahydropyrano[5,4-d][1,3,6]Dioxazocin-8-Yl]Oxy]-8,10-Dihydro-7H-Tetracene-5,12-Dione
• Synonyms: 9-Acetyl-4,6,9,11-Tetrahydroxy-7-[[2-(2-Hydroxypropyl)-4,10-Dimethyl-4,6A,7,8,10,10A-Hexahydropyrano[5,4-D][1,3,6]Dioxazocin-8-Yl]Oxy]-8,10-Dihydro-7H-Tetracene-5,12-Quinone; 9-Ethanoyl-4,6,9,11-Tetrahydroxy-7-[[2-(2-Hydroxypropyl)-4,10-Dimethyl-4,6A,7,8,10,10A-Hexahydropyrano[5,4-D][1,3,6]Dioxazocin-8-Yl]Oxy]-8,10-Dihydro-7H-Tetracene-5,12-Dione; 5,12-Naphthacenedione, 8-Acetyl-10-((4,6A,7,8,10,10A-Hexahydro-2-(2-Hydroxypropyl)-4,10-Dimethylpyrano(3,4-D)-1,3,6-Dioxazocin-8-Yl)Oxy)-7,8,9,10-Tetrahydro-1,6,8,``-Tetrahydroxy-
• Molecular Formula: C₃₃H₃₇NO₁₂
• Molecular Weight: 639.65
• CAS Registry Number: 108147-17-7
• SMILES: C6=C5C(=O)C1=C(C(=C2C(=C1O)CC(O)(CC2OC4OC(C3OC(OC(C=NC3C4)C)CC(O)C)C)C(=O)C)O)C(=O)C5=C(O)C=C6
• InChI: 1S/C33H37NO12/c1-13(35)8-22-43-14(2)12-34-19-9-23(44-15(3)32(19)46-22)45-21-11-33(42,16(4)36)10-18-25(21)31(41)27-26(29(18)39)28(38)17-6-5-7-20(37)24(17)30(27)40/h5-7,12-15,19,21-23,32,35,37,39,41-42H,8-11H2,1-4H3
• InChIKey: WFTIALXZVDZJDB-UHFFFAOYSA-N

Properties

• Density: 1.59g/cm³ (Cal.)
• Boiling point: 829.714°C at 760 mmHg (Cal.)
• Flash point: 455.595°C (Cal.)