(12beta)-12-bromo-12,13-deepoxy-13-hydroxy-Triptolide
[CAS# 137149-64-5]

Identification

• Name: (12beta)-12-bromo-12,13-deepoxy-13-hydroxy-Triptolide
• Synonyms: Tripbromolide; Triptolide, 12-Bromo-12,13-Deepoxy-13-Hydroxy-, (12Beta)-
• Molecular Formula: C₂₀H₂₅BrO₆
• Molecular Weight: 441.32
• CAS Registry Number: 137149-64-5
• SMILES: [C@]124O[C@H]1[C@@H](Br)[C@](O)([C@@H](O)[C@@]23O[C@H]3C[C@@H]5[C@@]4(CCC6=C5COC6=O)C)C(C)C
• InChI: 1S/C20H25BrO6/c1-8(2)18(24)13(21)14-20(27-14)17(3)5-4-9-10(7-25-15(9)22)11(17)6-12-19(20,26-12)16(18)23/h8,11-14,16,23-24H,4-7H2,1-3H3/t11-,12-,13+,14-,16+,17-,18-,19+,20+/m0/s1
• InChIKey: TUMFKARHYGRRPA-LZVGCMTRSA-N

Properties

• Density: 1.658g/cm³ (Cal.)
• Boiling point: 640.651°C at 760 mmHg (Cal.)
• Flash point: 341.254°C (Cal.)