| SpectraBase Spectrum ID |
IVwvQxkbAGz |
| Name |
Cholestan-6-one, 3-chloro-, cyclic 1,2-ethanediyl acetal, (3.beta.,5.alpha.)- |
| Alternate Name(s) |
(1'S,2'R,5'S,7'S,10'S,11'S,14'R,15'R)-5'-chloro-2',15'-dimethyl-14'-[(2R)-6-methylheptan-2-yl]spiro[1,3-dioxolane-2,8'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane]
3.beta.-chloro-6,6-ethylenedioxy-5.alpha.-cholestane |
| CAS Registry Number |
35868-80-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H49ClO2 |
| InChI |
InChI=1S/C29H49ClO2/c1-19(2)7-6-8-20(3)23-9-10-24-22-18-29(31-15-16-32-29)26-17-21(30)11-13-28(26,5)25(22)12-14-27(23,24)4/h19-26H,6-18H2,1-5H3/t20-,21+,22+,23-,24+,25+,26+,27-,28-/m1/s1 |
| InChIKey |
LJXRUKWHWLMWRJ-WFRQTHGZSA-N |
| Molecular Weight |
465.162 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])CC3([C@]2(C[C@](CC1)(Cl)[H])[H])OCCO3)[H])C |
| SPLASH |
splash10-0006-2090200000-24eb626d7e84cb3dc934 |
| Source of Spectrum |
O6-0-1095-0 |
| Wiley ID |
1391614 |
