Methyl (15beta)-20-Hydroxy-2,16-Didehydrocuran-17-Oate
[CAS# 5980-01-8]

Identification

• Name: Methyl (15beta)-20-Hydroxy-2,16-Didehydrocuran-17-Oate
• Molecular Formula: C₂₀H₂₄N₂O₃
• Molecular Weight: 340.42
• CAS Registry Number: 5980-01-8
• SMILES: O=C(OC)/C4=C2\Nc1ccccc1[C@@]23CCN5[C@H]3C[C@H]4[C@@](O)(CC)C5
• InChI: 1S/C20H24N2O3/c1-3-19(24)11-22-9-8-20-12-6-4-5-7-14(12)21-17(20)16(18(23)25-2)13(19)10-15(20)22/h4-7,13,15,21,24H,3,8-11H2,1-2H3/t13-,15+,19-,20-/m1/s1
• InChIKey: DGKIJZKKTDPACC-CTNSEHHHSA-N

Properties

• Density: 1.345g/cm³ (Cal.)
• Boiling point: 507.698°C at 760 mmHg (Cal.)
• Flash point: 260.847°C (Cal.)