Patulolide A
[CAS# 97143-16-3]

Identification

• Name: Patulolide A
• Synonyms: (3E,12R)-12-Methyl-1-Oxacyclododec-3-Ene-2,5-Quinone; Oxacyclododec-3-Ene-2,5-Dione, 12-Methyl-, (R-(E))-; Patulolide A
• Molecular Formula: C₁₂H₁₈O₃
• Molecular Weight: 210.27
• CAS Registry Number: 97143-16-3 (103729-43-7)
• SMILES: [C@@H]1(OC(/C=C/C(=O)CCCCCC1)=O)C
• InChI: 1S/C12H18O3/c1-10-6-4-2-3-5-7-11(13)8-9-12(14)15-10/h8-10H,2-7H2,1H3/b9-8+/t10-/m1/s1
• InChIKey: XETYGXGLGYXEIT-AAXQSMANSA-N

Properties

• Density: 1g/cm³ (Cal.)
• Boiling point: 364.339°C at 760 mmHg (Cal.)
• Flash point: 161.834°C (Cal.)