(3b)-Olean-12-ene-3,28-diol 28-acetate
[CAS# 51820-71-4]

Identification

• Name: (3b)-Olean-12-ene-3,28-diol 28-acetate
• Synonyms: Acetic Acid [(4As,6Ar,6As,6Br,10S,12Ar,14Br)-10-Hydroxy-2,2,6A,6B,9,9,12A-Heptamethyl-1,3,4,5,6,6A,7,8,8A,10,11,12,13,14B-Tetradecahydropicen-4A-Yl]Methyl Ester; [(4As,6Ar,6As,6Br,10S,12Ar,14Br)-10-Hydroxy-2,2,6A,6B,9,9,12A-Heptamethyl-1,3,4,5,6,6A,7,8,8A,10,11,12,13,14B-Tetradecahydropicen-4A-Yl]Methyl Ethanoate; 28-Acetoxyerythrodiol
• Molecular Formula: C₃₂H₅₂O₃
• Molecular Weight: 484.76
• CAS Registry Number: 51820-71-4
• SMILES: [C@@]23([C@@H]([C@@]1(C(C([C@@H](O)CC1)(C)C)CC2)C)CC=C4[C@]3(CC[C@@]5([C@@H]4CC(CC5)(C)C)COC(=O)C)C)C
• InChI: 1S/C32H52O3/c1-21(33)35-20-32-17-15-27(2,3)19-23(32)22-9-10-25-29(6)13-12-26(34)28(4,5)24(29)11-14-31(25,8)30(22,7)16-18-32/h9,23-26,34H,10-20H2,1-8H3/t23-,24?,25-,26+,29+,30-,31-,32-/m1/s1
• InChIKey: MOMZFICIDJEWQF-SLWKHJNRSA-N

Properties

• Density: 1.063g/cm³ (Cal.)
• Boiling point: 537.301°C at 760 mmHg (Cal.)
• Flash point: 193.748°C (Cal.)