7-[(2R,4S,5S,6S)-4-Dimethylamino-5-Hydroxy-6-Methyloxan-2-Yl]Oxy-9-Ethyl-4,9,10,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione
[CAS# 119446-00-3]

Identification

• Name: 7-[(2R,4S,5S,6S)-4-Dimethylamino-5-Hydroxy-6-Methyloxan-2-Yl]Oxy-9-Ethyl-4,9,10,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione
• Synonyms: 7-[(2R,4S,5S,6S)-4-Dimethylamino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-9-Ethyl-4,9,10,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 7-[[(2R,4S,5S,6S)-4-Dimethylamino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-9-Ethyl-4,9,10,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 7-[(2R,4S,5S,6S)-4-Dimethylamino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-9-Ethyl-4,9,10,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone
• Molecular Formula: C₂₈H₃₃NO₉
• Molecular Weight: 527.57
• CAS Registry Number: 119446-00-3
• SMILES: [C@@H]5(OC2C1=CC3=C(C(=C1C(O)C(O)(C2)CC)O)C(=O)C4=C(C3=O)C(=CC=C4)O)O[C@H]([C@@H](O)[C@@H](N(C)C)C5)C
• InChI: 1S/C28H33NO9/c1-5-28(36)11-18(38-19-10-16(29(3)4)23(31)12(2)37-19)14-9-15-21(26(34)22(14)27(28)35)24(32)13-7-6-8-17(30)20(13)25(15)33/h6-9,12,16,18-19,23,27,30-31,34-36H,5,10-11H2,1-4H3/t12-,16-,18?,19-,23+,27?,28?/m0/s1
• InChIKey: ORPXAKRJDMYLPY-DCDGKKTRSA-N

Properties

• Density: 1.491g/cm³ (Cal.)
• Boiling point: 766.417°C at 760 mmHg (Cal.)
• Flash point: 417.314°C (Cal.)