9-O-Daunosaminyl-4-Demethoxydaunorubicin
[CAS# 99457-12-2]

Identification

• Name: 9-O-Daunosaminyl-4-Demethoxydaunorubicin
• Synonyms: 9-Acetyl-8,9-Bis[(4-Amino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy]-6,11-Dihydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione Dihydrochloride; 9-Acetyl-8,9-Bis[(4-Amino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-6,11-Dihydroxy-8,10-Dihydro-7H-Tetracene-5,12-
• Molecular Formula: C₃₂H₄₀Cl₂N₂O₁₁
• Molecular Weight: 699.58
• CAS Registry Number: 99457-12-2
• SMILES: [H+].[H+].C6=C5C(=O)C4=C(O)C3=C(CC(OC1OC(C(O)C(N)C1)C)C(OC2OC(C(O)C(N)C2)C)(C3)C(=O)C)C(=C4C(=O)C5=CC=C6)O.[Cl-].[Cl-]
• InChI: 1S/C32H38N2O11.2ClH/c1-12-26(36)19(33)9-22(42-12)44-21-8-17-18(11-32(21,14(3)35)45-23-10-20(34)27(37)13(2)43-23)31(41)25-24(30(17)40)28(38)15-6-4-5-7-16(15)29(25)39;;/h4-7,12-13,19-23,26-27,36-37,40-41H,8-11,33-34H2,1-3H3;2*1H
• InChIKey: ZCYOZMZVADHTNV-UHFFFAOYSA-N

Properties

• Boiling point: 869.6°C at 760 mmHg (Cal.)
• Flash point: 479.7°C (Cal.)