Daunomycinol
[CAS# 28008-55-1]

Identification

• Classification: API >> Antineoplastic agents >> Antibiotic antineoplastic agents
• Name: Daunomycinol
• Synonyms: 7-(4-Amino-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 Hydrochloride; 7-[(4-Amino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-6,9,11-Trihydroxy-9-(1-Hydroxyethyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione Hydrochloride; 7-(4-Amino-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 Hydrochloride
• Molecular Formula: C₂₇H₃₂ClNO₁₀
• Molecular Weight: 566.00
• CAS Registry Number: 28008-55-1
• SMILES: [H+].C1=CC=C(OC)C5=C1C(=O)C4=C(O)C3=C(C(OC2OC(C(O)C(N)C2)C)CC(O)(C3)C(O)C)C(=C4C5=O)O.[Cl-]
• InChI: 1S/C27H31NO10.ClH/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33;/h4-6,10-11,14,16-17,22,29-30,32,34-35H,7-9,28H2,1-3H3;1H
• InChIKey: LQLMJJJLWJUAMM-UHFFFAOYSA-N

Properties

• Boiling point: 772.1°C at 760 mmHg (Cal.)
• Flash point: 420.7°C (Cal.)