Aranciamycinone
[CAS# 95722-75-1]

Identification

• Name: Aranciamycinone
• Synonyms: 1,6,11(2H)-Naphthacenetrione, 3,4-Dihydro-2,4,5,7-Tetrahydroxy-3-Methoxy-2-Methyl-; 3,4-Dihydro-2,4,5,7-Tetrahydroxy-3-Methoxy-2-Methyl-1,6,11(2H)-Naphthacenetrione; Aranciamycinone
• Molecular Formula: C₂₀H₁₆O₈
• Molecular Weight: 384.34
• CAS Registry Number: 95722-75-1
• SMILES: C1=C4C(=C(O)C3=C1C(=O)C2=CC=CC(=C2C3=O)O)C(O)C(OC)C(O)(C4=O)C
• InChI: 1S/C20H16O8/c1-20(27)18(26)9-6-8-12(16(24)13(9)17(25)19(20)28-2)15(23)11-7(14(8)22)4-3-5-10(11)21/h3-6,17,19,21,24-25,27H,1-2H3
• InChIKey: IMBONAKHRALLLQ-UHFFFAOYSA-N

Properties

• Density: 1.681g/cm³ (Cal.)
• Boiling point: 701.515°C at 760 mmHg (Cal.)
• Flash point: 255.578°C (Cal.)