N-Ethyl-13-Dihydrorubomycin
[CAS# 70844-03-0]

Identification

• Name: N-Ethyl-13-Dihydrorubomycin
• Synonyms: 7-(4-Dimethylamino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-6,9,11-Trihydroxy-9-(1-Hydroxyethyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 7-[(4-Dimethylamino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-6,9,11-Trihydroxy-9-(1-Hydroxyethyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 7-(4-Dimethylamino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-6,9,11-Trihydroxy-9-(1-Hydroxyethyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone
• Molecular Formula: C₂₉H₃₅NO₁₀
• Molecular Weight: 557.60
• CAS Registry Number: 70844-03-0
• SMILES: C5=C4C(=O)C1=C(C(=C2C(=C1O)CC(O)(CC2OC3OC(C(O)C(N(C)C)C3)C)C(O)C)O)C(=O)C4=C(OC)C=C5
• InChI: 1S/C29H35NO10/c1-12-24(32)16(30(3)4)9-19(39-12)40-18-11-29(37,13(2)31)10-15-21(18)28(36)23-22(26(15)34)25(33)14-7-6-8-17(38-5)20(14)27(23)35/h6-8,12-13,16,18-19,24,31-32,34,36-37H,9-11H2,1-5H3
• InChIKey: JGJCCAYOEOPUMT-UHFFFAOYSA-N

Properties

• Density: 1.485g/cm³ (Cal.)
• Boiling point: 765.954°C at 760 mmHg (Cal.)
• Flash point: 417.034°C (Cal.)