| SpectraBase Spectrum ID |
6h40Hj1KnKS |
| Name |
3.beta.-((Methylmercurio)methyl)-A,B-dinor-5.beta.-cholestane-5-carbaldehyde |
| Alternate Name(s) |
({(3R,3aR,5aS,5bR,8S,9R,9aS,9bS)-3-[(1R)-1,5-dimethylhexyl]-9-formyl-3a,5b-dimethyltetradecahydro-1H-cyclopenta[b]as-indacen-8-yl}methyl)(methyl)mercury |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H48HgO |
| InChI |
InChI=1S/C27H45O.CH3.Hg/c1-17(2)8-7-9-18(3)21-10-11-22-24-20(16-28)25-19(4)12-14-27(25,6)23(24)13-15-26(21,22)5;;/h16-25H,4,7-15H2,1-3,5-6H3;1H3;/t18-,19+,20-,21-,22+,23+,24+,25?,26-,27-;;/m1../s1 |
| InChIKey |
AYOVKBCLIZZXFQ-YTNBFNRJSA-N |
| Molecular Weight |
601.283 g/mol |
| SMILES |
[C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])[C@](C2[C@@](C[Hg]C)(CC1)[H])(C=O)[H])[H])C |
| SPLASH |
splash10-00kr-0049000000-f93f008cfabd868ec34d |
| Source of Spectrum |
C-116-196-27 |
| Wiley ID |
1410271 |
