| SpectraBase Spectrum ID |
A9NMjqEb1Zm |
| Name |
5-Acetyl-3.beta.-[(methylmercurio)methyl]-A,B-dinor-5.beta.-cholestane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H50HgO |
| InChI |
InChI=1S/C28H47O.CH3.Hg/c1-18(2)9-8-10-19(3)23-11-12-24-22-17-28(21(5)29)20(4)13-16-27(28,7)25(22)14-15-26(23,24)6;;/h18-20,22-25H,4,8-17H2,1-3,5-7H3;1H3;/t19-,20+,22?,23-,24+,25?,26-,27-,28-;;/m1../s1 |
| InChIKey |
XQNWCZOZVKKNIT-TYQXJSFQSA-N |
| Molecular Weight |
615.310 g/mol |
| SMILES |
[C@]12([C@@](CC3C2CC[C@@]2([C@]([C@@](CCCC(C)C)(C)[H])([H])CC[C@@]32[H])C)(C(=O)C)[C@@](C[Hg]C)(CC1)[H])C |
| SPLASH |
splash10-0002-0009000000-441f39ae5a31350f1a55 |
| Source of Spectrum |
J-64-113-27 |
| Synonyms |
5-Acetyl-3.beta.-[(methylmercurio)methyl]-A,B-bisnor-5.beta.-cholestane |
| Wiley ID |
1529183 |
![5-Acetyl-3.beta.-[(methylmercurio)methyl]-A,B-dinor-5.beta.-cholestane](/api/spectrum/A9NMjqEb1Zm/structure.png?h=300&w=458 "5-Acetyl-3.beta.-[(methylmercurio)methyl]-A,B-dinor-5.beta.-cholestane")
