(1E,4S,5E,7R,9E,11aR,14S,14aR,15S,15aR,16aS,16bR)-7-(Acetyloxy)-4,7,14,14a,15,15a,16a,16b-octahydro-4,6,15,15a-tetramethyl-14-(phenylmethyl)-3H-Cyclotridec(d)oxireno(f)isoindole-8,11,12(13H)-trione
[CAS# 79648-72-9]

Identification

• Name: (1E,4S,5E,7R,9E,11aR,14S,14aR,15S,15aR,16aS,16bR)-7-(Acetyloxy)-4,7,14,14a,15,15a,16a,16b-octahydro-4,6,15,15a-tetramethyl-14-(phenylmethyl)-3H-Cyclotridec(d)oxireno(f)isoindole-8,11,12(13H)-trione
• Molecular Formula: C₃₂H₃₇NO₆
• Molecular Weight: 531.65
• CAS Registry Number: 79648-72-9
• SMILES: [C@]234[C@@H]([C@@H]([C@]1(O[C@H]1[C@@H]2\C=C\C[C@@H](\C=C(/[C@@H](OC(=O)C)C(=O)/C=C/C3=O)C)C)C)C)[C@@H](NC4=O)CC5=CC=CC=C5
• InChI: 1S/C32H37NO6/c1-18-10-9-13-23-29-31(5,39-29)20(3)27-24(17-22-11-7-6-8-12-22)33-30(37)32(23,27)26(36)15-14-25(35)28(19(2)16-18)38-21(4)34/h6-9,11-16,18,20,23-24,27-29H,10,17H2,1-5H3,(H,33,37)/b13-9+,15-14+,19-16-/t18-,20-,23-,24-,27-,28+,29-,31+,32+/m0/s1
• InChIKey: AZWOSJCABFILKS-XZRSCLCVSA-N

Properties

• Density: 1.237g/cm³ (Cal.)
• Boiling point: 703.816°C at 760 mmHg (Cal.)
• Flash point: 379.454°C (Cal.)