| SpectraBase Spectrum ID |
Kcr3jwblNrU |
| Name |
3-Thia-5.alpha.-cholestane 3,3-dioxide |
| CAS Registry Number |
125303-45-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H46O2S |
| InChI |
InChI=1S/C26H46O2S/c1-18(2)7-6-8-19(3)22-11-12-23-21-10-9-20-17-29(27,28)16-15-25(20,4)24(21)13-14-26(22,23)5/h18-24H,6-17H2,1-5H3/t19-,20+,21+,22-,23+,24+,25+,26-/m1/s1 |
| InChIKey |
OYLLEGARPYULTJ-FHNVJLOUSA-N |
| Molecular Weight |
422.712 g/mol |
| SMILES |
C1S(CC[C@@]2([C@]3(CC[C@@]4([C@](CC[C@]4([C@@]3(CC[C@@]12[H])[H])[H])([C@@](CCCC(C)C)(C)[H])[H])C)[H])C)(=O)=O |
| SPLASH |
splash10-01b9-0060900000-aa3da9f66b3e23243c74 |
| Source of Spectrum |
J-55-2174-14 |
| Synonyms |
(4aR,4bS,6aR,7R,9aS,9bS,11aR)-7-[(1R)-1,5-dimethylhexyl]-4a,6a-dimethylhexadecahydrocyclopenta[5,6]naphtho[2,1-c]thiopyran 2,2-dioxide |
| Wiley ID |
1378755 |
