![Androst-16-en-3-ol, 16,17-[1,2-ethanediylbis(thio)]-, (3.alpha.,5.alpha.)-](/api/spectrum/7LQwh8d7RwZ/structure.png?h=300&w=458 "Androst-16-en-3-ol, 16,17-[1,2-ethanediylbis(thio)]-, (3.alpha.,5.alpha.)-")
| SpectraBase Compound ID | JMNLAwp30on |
|---|---|
| InChI | InChI=1S/C21H32OS2/c1-20-7-5-14(22)11-13(20)3-4-15-16(20)6-8-21(2)17(15)12-18-19(21)24-10-9-23-18/h13-17,22H,3-12H2,1-2H3/t13-,14+,15+,16-,17-,20-,21-/m0/s1 |
| InChIKey | CSMIPFQLAVRXQL-XEVKMFBRSA-N |
| Mol Weight | 364.6 g/mol |
| Molecular Formula | C21H32OS2 |
| Exact Mass | 364.189458 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7LQwh8d7RwZ |
|---|---|
| Name | Androst-16-en-3-ol, 16,17-[1,2-ethanediylbis(thio)]-, (3.alpha.,5.alpha.)- |
| CAS Registry Number | 90692-06-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H32OS2 |
| InChI | InChI=1S/C21H32OS2/c1-20-7-5-14(22)11-13(20)3-4-15-16(20)6-8-21(2)17(15)12-18-19(21)24-10-9-23-18/h13-17,22H,3-12H2,1-2H3/t13-,14+,15+,16-,17-,20-,21-/m0/s1 |
| InChIKey | CSMIPFQLAVRXQL-XEVKMFBRSA-N |
| Molecular Weight | 364.606 g/mol |
| SMILES | O[C@@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC[C@]2(C1)[H])[H])(CC1=C4SCCS1)[H])C)[H])C)[H] |
| SPLASH | splash10-01ot-0009000000-3a5409351adffe71ece0 |
| Source of Spectrum | K-117-1692-0 |
| Synonyms | (2R,4aS,4bS,6aS,11aS,11bR,13aS)-4a,6a-dimethyl-2,3,4,4a,4b,5,6,6a,8,9,11,11a,11b,12,13,13a-hexadecahydro-1H-naphtho[2',1':4,5]indeno[1,2-b][1,4]dithiin-2-ol 1H-naphth[2',1':4,5]indeno[1,2-b][1,4]dithiin, androst-16-en-3-ol deriv. 5',6'-Dihydro-3.alpha.-hydroxy-5.alpha.-androst-16-eno[16,17-b][1,4]dithiine |
| Wiley ID | 1350874 |