3'-(4-Morpholinyl)-3'-Deaminodaunorubicin
[CAS 79867-78-0]

Identification

• Name: 3'-(4-Morpholinyl)-3'-Deaminodaunorubicin
• Synonyms: 5,12-Naphthacenedione, 7,8,9,10-Tetrahydro-8-Acetyl-1-Methoxy-10-((2,3,6-Trideoxy-3-(4-Morpholinyl)-Alpha-L-Lyxo-Hexopyranosyl)Oxy)-6,8,11-Trihydroxy-, (8S-Cis)-; 5,12-Naphthacenedione, 8-Acetyl-7,8,9,10-Tetrahydro-6,8,11-Trihydroxy-1-Methoxy-10-((2,3,6-Trideoxy-3-(4-Morpholinyl)-Alpha-L-Lyxo-Hexopyranosyl)Oxy)-, (8S-Cis)-; Brn 5232668
• Molecular Formula: C₃₁H₃₅NO₁₁
• Molecular Weight: 597.62
• CAS Registry Number: 79867-78-0
• SMILES: [C@H]6(N1CCOCC1)C[C@H](OC2CC(O)(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)C(=O)C)OC([C@@H]6O)C
• InChI: 1S/C31H35NO11/c1-14-26(34)18(32-7-9-41-10-8-32)11-21(42-14)43-20-13-31(39,15(2)33)12-17-23(20)30(38)25-24(28(17)36)27(35)16-5-4-6-19(40-3)22(16)29(25)37/h4-6,14,18,20-21,26,34,36,38-39H,7-13H2,1-3H3/t14?,18-,20?,21-,26-,31?/m0/s1
• InChIKey: OYIWRKOSDGPKFD-NMOJSDROSA-N

Properties

• Density: 1.518g/cm³ (Cal.)
• Boiling point: 805.593°C at 760 mmHg (Cal.)
• Flash point: 441.007°C (Cal.)