4-Demethoxy-10,10-Dimethyldaunomycin
[CAS# 91003-74-6]

Identification

• Name: 4-Demethoxy-10,10-Dimethyldaunomycin
• Synonyms: 9-Acetyl-7-(4-Amino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-6,9,11-Trihydroxy-10,10-Dimethyl-7,8-Dihydrotetracene-5,12-Dione; 9-Acetyl-7-[(4-Amino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-6,9,11-Trihydroxy-10,10-Dimethyl-7,8-Dihydrotetracene-5,12-Di
• Molecular Formula: C₂₈H₃₁NO₉
• Molecular Weight: 525.55
• CAS Registry Number: 91003-74-6
• SMILES: C1=CC=CC3=C1C(=O)C2=C(O)C5=C(C(=C2C3=O)O)C(OC4OC(C(O)C(N)C4)C)CC(O)(C5(C)C)C(=O)C
• InChI: 1S/C28H31NO9/c1-11-22(31)15(29)9-17(37-11)38-16-10-28(36,12(2)30)27(3,4)21-18(16)25(34)19-20(26(21)35)24(33)14-8-6-5-7-13(14)23(19)32/h5-8,11,15-17,22,31,34-36H,9-10,29H2,1-4H3
• InChIKey: OTPATBBARNDVSI-UHFFFAOYSA-N

Properties

• Density: 1.5g/cm³ (Cal.)
• Boiling point: 721.708°C at 760 mmHg (Cal.)
• Flash point: 390.275°C (Cal.)