Nilestriol
(8R,9S,13S,14S,16R,17R)-3-cyclopentyloxy-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-16,17-diol
Also Known As: Nilestriol|NYLESTRIOL|Nilestriolum|Nilestriol [INN]|Nylestriol [USAN]|Nilestriol (INN)|Nylestriol (USAN)|EE3CPE|7JA3B3IALU|Lilly 49825|Nilestriolum [INN-Latin]|AC1L1ZKW|Nylestriol [USAN:BAN]|RefChem:166995|Nylestriol [USAN:INN:BAN]|NILESTRIOL [WHO-DD]|orb1306547|LY 49825|8184AH|17 alpha-ethinylestriol 3-cyclopentyl ether|17 alpha-ethynylestriol 3-cyclopentyl ether|J16.450J|SID:53788546|D05212|T20744|791N203|A824736|C010722|C470148|19-Norpregna-1,3,5(10)-trien-20-yne-16,17-diol, 3-(cyclopentyloxy)-, (16alpha,17alpha)-|Q27268409|17alpha-Ethynylestra-1,3,5(10)-triene-3,16alpha,17beta-triol 3-cyclopentyl ether
| Molecular Formula | C25H32O3 |
|---|---|
| Molecular Weight | 380.23514 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 49.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 380.23514 |
| Heavy Atoms | 28 |
| Complexity | 804.5 |
Chemical Identifiers
| CAS Number | 39791-20-3 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@H]([C@]2(C#C)O)O)CCC4=C3C=CC(=C4)OC5CCCC5 |
Product Overview
Nilestriol (CAS 39791-20-3), with molecular formula C25H32O3 and molecular weight 380.23514 g/mol. IUPAC: (8R,9S,13S,14S,16R,17R)-3-cyclopentyloxy-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-16,17-diol.
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