(4beta)-12,13-Epoxy-4-Hydroxy-Trichothec-9-En-8-One
[CAS# 2199-06-6]

Identification

• Name: (4beta)-12,13-Epoxy-4-Hydroxy-Trichothec-9-En-8-One
• Synonyms: Trichothecolone; (4Beta)-12,13-Epoxy-4-Hydroxytrichothec-9-En-8-One
• Molecular Formula: C₁₅H₂₀O₄
• Molecular Weight: 264.32
• CAS Registry Number: 2199-06-6
• SMILES: [C@]23(C1(C)C4([C@@H](C[C@H]1O)O[C@@H]2C=C(C(C3)=O)C)CO4)C
• InChI: 1S/C15H20O4/c1-8-4-11-13(2,6-9(8)16)14(3)10(17)5-12(19-11)15(14)7-18-15/h4,10-12,17H,5-7H2,1-3H3/t10-,11-,12-,13+,14?,15?/m1/s1
• InChIKey: BURHPZJXARNGQY-YNBGEIFUSA-N

Properties

• Density: 1.296g/cm³ (Cal.)
• Boiling point: 431.764°C at 760 mmHg (Cal.)
• Flash point: 162.702°C (Cal.)