Bisnorcholenaldehyde - CAS 3986-89-8

Catalog: BB061816
Product Name: Bisnorcholenaldehyde
CAS: 3986-89-8
Synonyms: (20S)-3-Oxo-pregn-4-ene-20-carboxaldehyde
Bisnorcholenaldehyde
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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