(3beta,16alpha,20beta)-28,29-Epoxy-29-Methoxy-Olean-12-Ene-3,16-Diol
[CAS# 73947-05-4]

Identification

• Name: (3beta,16alpha,20beta)-28,29-Epoxy-29-Methoxy-Olean-12-Ene-3,16-Diol
• Molecular Formula: C₃₁H₅₀O₄
• Molecular Weight: 486.73
• CAS Registry Number: 73947-05-4
• SMILES: [C@@]13([C@]4(C(=CC[C@@H]1[C@@]2(C(C([C@@H](O)CC2)(C)C)CC3)C)[C@@H]5[C@@]6([C@H](O)C4)CC[C@](C5)(C(OC6)OC)C)C)C
• InChI: 1S/C31H50O4/c1-26(2)21-10-13-29(5)22(28(21,4)12-11-23(26)32)9-8-19-20-16-27(3)14-15-31(20,18-35-25(27)34-7)24(33)17-30(19,29)6/h8,20-25,32-33H,9-18H2,1-7H3/t20-,21?,22-,23+,24-,25?,27-,28+,29-,30-,31-/m1/s1
• InChIKey: IYCGYNCOJVAGQX-LKMCRQILSA-N

Properties

• Density: 1.136g/cm³ (Cal.)
• Boiling point: 580.45°C at 760 mmHg (Cal.)
• Flash point: 304.846°C (Cal.)