(1R,2S,4R,7S,8R)-2-Hydroxy-1,7,8-Trimethyl-17-Methylene-15-Oxatricyclo[9.3.2.14,8]Heptadec-11-En-16-One
[CAS# 72188-81-9]

Identification

• Name: (1R,2S,4R,7S,8R)-2-Hydroxy-1,7,8-Trimethyl-17-Methylene-15-Oxatricyclo[9.3.2.14,8]Heptadec-11-En-16-One
• Synonyms: Cleomeolide; Nsc329506
• Molecular Formula: C₂₀H₃₀O₃
• Molecular Weight: 318.46
• CAS Registry Number: 72188-81-9
• SMILES: CC23C(C(CC(C1(C)OC(C(=CCC1)CC2)=O)O)CCC3C)=C
• InChI: 1S/C20H30O3/c1-13-7-8-16-12-17(21)20(4)10-5-6-15(18(22)23-20)9-11-19(13,3)14(16)2/h6,13,16-17,21H,2,5,7-12H2,1,3-4H3
• InChIKey: SHAHCGJNHYXFLV-UHFFFAOYSA-N

Properties

• Density: 1.088g/cm³ (Cal.)
• Boiling point: 474.149°C at 760 mmHg (Cal.)
• Flash point: 190.534°C (Cal.)