Preussomerin I
[CAS# 158204-29-6]

Identification

• Name: Preussomerin I
• Molecular Formula: C₂₁H₁₄O₈
• Molecular Weight: 394.34
• CAS Registry Number: 158204-29-6
• SMILES: [C@@H]7(C25OC3(C1=C(C(=CC=C1O2)O)C(=O)C4OC34)OC6=CC=CC(=C56)C(=O)C7)OC
• InChI: 1S/C21H14O8/c1-25-13-7-10(23)8-3-2-4-11-15(8)20(13)27-12-6-5-9(22)14-16(12)21(28-11,29-20)19-18(26-19)17(14)24/h2-6,13,18-19,22H,7H2,1H3/t13-,18?,19?,20?,21?/m1/s1
• InChIKey: NVGIJVUQQFDOAD-IBDSJRNGSA-N

Properties

• Density: 1.75g/cm³ (Cal.)
• Boiling point: 737.939°C at 760 mmHg (Cal.)
• Flash point: 272.288°C (Cal.)