7-(4-Amino-5-Iodo-6-Methyloxan-2-Yl)Oxy-9-(1,2-Dihydroxyethyl)-6,9,11-Trihydroxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione
[CAS# 111865-30-6]

Identification

• Name: 7-(4-Amino-5-Iodo-6-Methyloxan-2-Yl)Oxy-9-(1,2-Dihydroxyethyl)-6,9,11-Trihydroxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione
• Synonyms: 7-(4-Amino-5-Iodo-6-Methyl-Tetrahydropyran-2-Yl)Oxy-9-(1,2-Dihydroxyethyl)-6,9,11-Trihydroxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 7-[(4-Amino-5-Iodo-6-Methyl-2-Tetrahydropyranyl)Oxy]-9-(1,2-Dihydroxyethyl)-6,9,11-Trihydroxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 7-(4-Amino-5-Iodo-6-Methyl-Tetrahydropyran-2-Yl)Oxy-9-(1,2-Dihydroxyethyl)-6,9,11-Trihydroxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone
• Molecular Formula: C₂₇H₃₀INO₁₀
• Molecular Weight: 655.44
• CAS Registry Number: 111865-30-6
• SMILES: C1=CC=C(OC)C5=C1C(=O)C4=C(O)C3=C(C(OC2OC(C(I)C(N)C2)C)CC(O)(C3)C(O)CO)C(=C4C5=O)O
• InChI: 1S/C27H30INO10/c1-10-22(28)13(29)6-17(38-10)39-15-8-27(36,16(31)9-30)7-12-19(15)26(35)21-20(24(12)33)23(32)11-4-3-5-14(37-2)18(11)25(21)34/h3-5,10,13,15-17,22,30-31,33,35-36H,6-9,29H2,1-2H3
• InChIKey: KLVKZKZLMNCPHM-UHFFFAOYSA-N

Properties

• Density: 1.82g/cm³ (Cal.)
• Boiling point: 830.941°C at 760 mmHg (Cal.)
• Flash point: 456.337°C (Cal.)