N,N-Dimethyladriamycin-14-Valerate
[CAS# 98910-80-6]

Identification

• Name: N,N-Dimethyladriamycin-14-Valerate
• Synonyms: [2-[4-(4-Dimethylamino-6-Hydroxy-5-Methyl-Tetrahydropyran-2-Yl)Oxy-2,5,12-Trihydroxy-7-Methoxy-6,11-Dioxo-3,4-Dihydro-1H-Tetracen-2-Yl]-2-Oxo-Ethyl] Pentanoate; Pentanoic Acid [2-[4-[(4-Dimethylamino-6-Hydroxy-5-Methyl-2-Tetrahydropyranyl)Oxy]-2,5,12-Trihy
• Molecular Formula: C₃₄H₄₁NO₁₂
• Molecular Weight: 655.70
• CAS Registry Number: 98910-80-6
• SMILES: C1=CC=C(OC)C3=C1C(=O)C2=C(O)C5=C(C(=C2C3=O)O)C(OC4OC(O)C(C(N(C)C)C4)C)CC(O)(C5)C(=O)COC(=O)CCCC
• InChI: 1S/C34H41NO12/c1-6-7-11-23(37)45-15-22(36)34(43)13-18-26(21(14-34)46-24-12-19(35(3)4)16(2)33(42)47-24)32(41)28-27(30(18)39)29(38)17-9-8-10-20(44-5)25(17)31(28)40/h8-10,16,19,21,24,33,39,41-43H,6-7,11-15H2,1-5H3
• InChIKey: TUGDDYYUXNGQOM-UHFFFAOYSA-N

Properties

• Density: 1.434g/cm³ (Cal.)
• Boiling point: 816.68°C at 760 mmHg (Cal.)
• Flash point: 447.712°C (Cal.)