A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol
(2S,3aS,3bS,5aS,6R,8aS,8bR,10aS)-2,6-diethynyl-3a,5a-dimethyl-1,3,3b,4,5,7,8,8a,8b,9,10,10a-dodecahydroindeno[5,4-e]indene-2,6-diol
Also Known As: Anordiol|AF 45|AF-45|KST-1A0443|A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol|H241|2,17,Diethynyl-2,17-dihydroxy-A-norandrostane|2,17-Diethynyl-2,17-dihydroxy-A-norandrostane|H 241|J3.029.302I|(2alpha,5alpha,17alpha)-2-Ethynyl-A-norpregn-20-yne-2,17-diol|A-Norpregn-20-yne-2,17-diol, 2-ethynyl-, (2alpha,5alpha,17alpha)-|(17R)-2-Ethynyl-A-nor-5alpha-pregna-20-yne-2alpha,17-diol|(1r,3as,3br,5as,7s,8as,8bs,10as)-1,7-diethynyl-8a,10a-dimethylhexadecahydrodicyclopenta[a,f]naphthalene-1,7-diol|(2S,3aS,3bS,5aS,6R,8aS,8bR,10aS)-2,6-diethynyl-3a,5a-dimethyl-1,3,3b,4,5,7,8,8a,8b,9,10,10a-dodecahydroindeno[5,4-e]indene-2,6-diol|A-norandrostane-2 alpha,17 alpha-diethynyl-2 beta,17 beta-diol|dihydroxy-2|A, 17|A diethynyl-2|A, 17|A A-nor(5|A)androstane|(2 alpha,5 alpha,17 alpha)-2-ethynyl-A-norpregn-20-yne-2,17-diol|Dicyclopenta(a,f)naphthalene-1,7-diol, 1,7-diethynylhexadecahydro-8a,10a-dimethyl-, (1R,3aS,3bR,5aS,7S,8aS,8bS,10aS)-|(1R,3aS,3bR,5aS,7S,8aS,8bS,10aS)-1,7-Diethynyl-8a,10a-dimethyl-hexadecahydro-dicyclopenta[a,f]naphthalene-1,7-diol|(1S,2S,4S,6S,9R,10S,13R,14S)-4,13-diethynyl-2,14-dimethyltetracyclo[7.7.0.02,6.010,14]hexadecane-4,13-diol
| Molecular Formula | C22H30O2 |
|---|---|
| Molecular Weight | 326.22458 g/mol |
| LogP | 3.37 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 326.22458 |
| Heavy Atoms | 24 |
| Complexity | 641.3 |
Chemical Identifiers
| CAS Number | 1045-30-3 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CC[C@@H]4[C@@]3(C[C@@](C4)(C#C)O)C |
Product Overview
A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol (CAS 1045-30-3), with molecular formula C22H30O2 and molecular weight 326.22458 g/mol. IUPAC: (2S,3aS,3bS,5aS,6R,8aS,8bR,10aS)-2,6-diethynyl-3a,5a-dimethyl-1,3,3b,4,5,7,8,8a,8b,9,10,10a-dodecahydroindeno[5,4-e]indene-2,6-diol.
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