(4-beta)-12,13-Epoxytrichothec-9-En-4-Ol
[CAS# 2198-93-8]

Identification

• Name: (4-beta)-12,13-Epoxytrichothec-9-En-4-Ol
• Synonyms: 12,13-Epoxytrichothec-9-En-4-Beta-Ol; Brn 1287601; Roridin C
• Molecular Formula: C₁₅H₂₂O₃
• Molecular Weight: 250.34
• CAS Registry Number: 2198-93-8
• SMILES: [C@H]13O[C@H]4[C@@](C(C12OC2)([C@H](O)C3)C)(CCC(=C4)C)C
• InChI: 1S/C15H22O3/c1-9-4-5-13(2)11(6-9)18-12-7-10(16)14(13,3)15(12)8-17-15/h6,10-12,16H,4-5,7-8H2,1-3H3/t10-,11-,12-,13+,14?,15?/m1/s1
• InChIKey: XSUVNTHNQMGPIL-YNBGEIFUSA-N

Properties

• Density: 1.209g/cm³ (Cal.)
• Boiling point: 373.238°C at 760 mmHg (Cal.)
• Flash point: 179.528°C (Cal.)