(3R,5S,8R,9S,10S,13R,14S,17R)-2',2'-dichloro-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,3'-cyclobutane]-1'-one
Compound with spectra: 1 NMR
![(3R,5S,8R,9S,10S,13R,14S,17R)-2',2'-dichloro-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,3'-cyclobutane]-1'-one](/api/compound/DN7Mczk2Xfq.png?ph=true&h=300&w=458 "(3R,5S,8R,9S,10S,13R,14S,17R)-2',2'-dichloro-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,3'-cyclobutane]-1'-one")
| SpectraBase Compound ID | DN7Mczk2Xfq |
|---|---|
| InChI | InChI=1S/C30H48Cl2O/c1-19(2)7-6-8-20(3)23-11-12-24-22-10-9-21-17-29(18-26(33)30(29,31)32)16-15-27(21,4)25(22)13-14-28(23,24)5/h19-25H,6-18H2,1-5H3/t20-,21+,22+,23-,24+,25+,27+,28-,29-/m1/s1 |
| InChIKey | CFEGNMIONRHTQI-PHEUYXDDSA-N |
| Mol Weight | 495.6 g/mol |
| Molecular Formula | C30H48Cl2O |
| Exact Mass | 494.308222 g/mol |
| Enantiomer InChIKey | CFEGNMIONRHTQI-PJVDIJOOSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
(3S)-2',2'-Dichloro-spiro[cholestane-3,1'-cyclopentan]-3'-one
(3R)-2',2'-Dichloro-spiro[cholestane-3,1'-cyclopentan]-3'-one
NZQHDZYVFGGYDT-SDIGTHNQSA-N
NZQHDZYVFGGYDT-WMIXUGNPSA-N
2'-.psi.-Methoxy-spiro[5-.alpha.-cholestane-3,3'-tetrahydrofuran]-5'-one
3-.alpha.-[2-(Hydroxymethyl)phenylmethyl]-5.alpha.-cholestan-3.beta.-ol
3-.beta.-[2-(Hydroxymethyl)phenylmethyl]-5.alpha.-cholestan-3.alpha.-ol
4'-.xi.-Chloro-3(R)-spiro[5.alpha.-cholestane-3,3'-pyrrolidin]-5'-one
4'.xi.-Chloro-(3R)-spiro[5.alpha.-cholestane-3,3'-pyrrolodin]-5'-one
| Title | Journal or Book | Year |
|---|---|---|
| 1H and13C NMR Data for Spiro Steroids, Derivatives of 5α-Cholestane | Magnetic Resonance in Chemistry | 1996 |