Carminomicin 3
[CAS# 50935-05-2]

Identification

• Name: Carminomicin 3
• Synonyms: 9-Acetyl-7-[4-Amino-5-[3-Hydroxy-1-(2-Hydroxy-1-Methyl-Ethoxy)Butoxy]-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4,6,9,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 9-Acetyl-7-[[4-Amino-5-[3-Hydroxy-1-(2-Hydroxy-1-Methylethoxy)Butoxy]-6-Methyl-2-Tetrahydropyranyl]Oxy]-4,6,9,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 9-Acetyl-7-[4-Amino-5-[3-Hydroxy-1-(2-Hydroxy-1-Methyl-Ethoxy)Butoxy]-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4,6,9,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone
• Molecular Formula: C₃₃H₄₁NO₁₃
• Molecular Weight: 659.69
• CAS Registry Number: 50935-05-2 (50935-06-3)
• SMILES: C5=C4C(=O)C1=C(C(=C2C(=C1O)CC(O)(CC2OC3OC(C(OC(OC(CO)C)CC(O)C)C(N)C3)C)C(=O)C)O)C(=O)C4=C(O)C=C5
• InChI: 1S/C33H41NO13/c1-13(36)8-22(44-14(2)12-35)47-32-15(3)45-23(9-19(32)34)46-21-11-33(43,16(4)37)10-18-25(21)31(42)27-26(29(18)40)28(39)17-6-5-7-20(38)24(17)30(27)41/h5-7,13-15,19,21-23,32,35-36,38,40,42-43H,8-12,34H2,1-4H3
• InChIKey: DNHXZQIEIKSDIK-UHFFFAOYSA-N

Properties

• Density: 1.507g/cm³ (Cal.)
• Boiling point: 880.315°C at 760 mmHg (Cal.)
• Flash point: 486.197°C (Cal.)