| SpectraBase Spectrum ID |
BJQ50dfVkNB |
| Name |
A-Norcholestane, 5-chloro-3-methyl-, (3.beta.,5.alpha.)- |
| CAS Registry Number |
71060-22-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H47Cl |
| InChI |
InChI=1S/C27H47Cl/c1-18(2)8-7-9-19(3)22-10-11-23-21-13-17-27(28)20(4)12-16-26(27,6)24(21)14-15-25(22,23)5/h18-24H,7-17H2,1-6H3/t19-,20+,21+,22-,23+,24+,25-,26-,27-/m1/s1 |
| InChIKey |
TUGJXYQPDVVIFC-POBUXQGNSA-N |
| Molecular Weight |
407.126 g/mol |
| SMILES |
[C@]12([C@@](CC[C@]3([C@@]4(CC[C@@]([C@]4(CC[C@]23[H])C)([C@@](CCCC(C)C)(C)[H])[H])[H])[H])([C@@](C)(CC1)[H])Cl)C |
| SPLASH |
splash10-0ab9-0019000000-c16b45e4630f2882fb93 |
| Source of Spectrum |
K-112-1611-0 |
| Synonyms |
Dicyclopenta[a,f]naphthalene, A-norcholestane deriv.
(1S,3aR,3bS,5aR,6R,8aS,8bS,10aR)-10a-chloro-6-[(1R)-1,5-dimethylhexyl]-1,3a,5a-trimethylhexadecahydrodicyclopenta[a,f]naphthalene
5.alpha.-chloro-3.beta.-methyl-a-nor-cholestane |
| Wiley ID |
1372430 |
