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| IUPAC Name: | (2S)-2-[(8S,9S,10R,13S,14S,17R)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]propanal |
| Description: | Bisnorcholenaldehyde can be used to prepare 27-Nor-Δ4-dafachronic acid as a synthetic ligand of Caenorhabditis elegans DAF-12 receptor. It is also used to synthesize 3b,6a-dihydroxy-5a-cholan-23-one. |
| Molecular Weight: | 328.49 |
| Molecular Formula: | C22H32O2 |
| Canonical SMILES: | CC(C=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C |
| InChI: | InChI=1S/C22H32O2/c1-14(13-23)18-6-7-19-17-5-4-15-12-16(24)8-10-21(15,2)20(17)9-11-22(18,19)3/h12-14,17-20H,4-11H2,1-3H3/t14-,17+,18-,19+,20+,21+,22-/m1/s1 |
| InChI Key: | XVPJEGGIGJLDQK-HOFZUOGSSA-N |
| Melting Point: | 156 - 1590C |
| Solubility: | Chloroform (Slightly), Dichloromethane (Slightly), Methanol (Slightly) |
| Appearance: | White to Off-White Solid |
| Storage: | -20°C, Inert atmosphere |
| References: | Samaja, G., et al. Bioorg. Med. Chem. Lett., 23, 2893 (2013); Nahar, L., et al. Tetrahedron, 59, 8623 (2003). |
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