alpha-Amyrin acetate
[(3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] acetate
Also Known As: alpha-Amyrin acetate|Amyrin acetate|A-amyrin acetate|alpha-Amyrenyl acetate|-myrin acetate|beta-Amyrin acetate|alfa-Amyrin Acetate|?-Amyrin acetate|alpha-Amyrinacetate|_-Amyrin acetate|3-acety alpha-amyrin|alpha-amyrin 3-acetate|.alpha.-Amyrin acetate|cent-Amyrin acetate|ALPHA-ACETYLAMYRIN|.alpha.-Amyrenyl acetate|3beta-Acetoxyurs-12-ene|.ALPHA.-ACETYLAMYRIN|3-O-ACETYL-ALPHA-AMYRIN|urs-12-en-3beta-yl acetate|Urs-12-en-3beta-ol acetate|Urs-12-en-3beta-ol(acetate)|Urs-12-en-3beta-ol, acetate|Ursane-12-ene-3beta-ol acetate|.ALPHA.-AMYRINONE ACETATE|Urs-12-en-3.beta.-ol, acetate|3-O-ACETYL-.ALPHA.-AMYRIN|HY-N2842|.ALPHA.-AMYRIN ACETATE [MI]|NP6297|Acetic acidurs-12-ene-3beta-yl ester|FS-9107
| Molecular Formula | C32H52O2 |
|---|---|
| Molecular Weight | 468.39673 g/mol |
| LogP | 8.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 468.39673 |
| Heavy Atoms | 34 |
| Complexity | 885.4 |
Chemical Identifiers
| CAS Number | 863-76-3 |
|---|---|
| SMILES | C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)OC(=O)C)C)C)[C@@H]2[C@H]1C)C)C |
Product Overview
alpha-Amyrin acetate (CAS 863-76-3), with molecular formula C32H52O2 and molecular weight 468.39673 g/mol. IUPAC: [(3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] acetate.
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