CAS 20168-88-1

(1′S,6′R)-7-Chloro-6-hydroxy-2′,4-dimethoxy-6′-methylspiro[benzofuran-2(3H),1′-[2]cyclohexene]-3,4′-dione

Description:

The chemical substance known as (1′S,6′R)-7-Chloro-6-hydroxy-2′,4-dimethoxy-6′-methylspiro[benzofuran-2(3H),1′-[2]cyclohexene]-3,4′-dione, with the CAS number 20168-88-1, exhibits a complex molecular structure characterized by a spirocyclic framework that integrates a benzofuran moiety and a cyclohexene derivative. This compound features multiple functional groups, including a chloro group, hydroxyl group, and methoxy groups, which contribute to its chemical reactivity and potential biological activity. The stereochemistry indicated by the (1′S,6′R) configuration suggests specific spatial arrangements that may influence its interactions with biological targets. Such compounds are often of interest in medicinal chemistry due to their potential pharmacological properties. The presence of the spiro structure may also impart unique conformational characteristics, affecting solubility and stability. Overall, this compound's intricate structure and functional groups make it a subject of interest for further research in various chemical and biological applications.

Formula: C₁₆H₁₅ClO₆

InChI: InChI=1S/C16H15ClO6/c1-7-4-8(18)5-11(22-3)16(7)15(20)12-10(21-2)6-9(19)13(17)14(12)23-16/h5-7,19H,4H2,1-3H3/t7-,16+/m1/s1

InChI key: InChIKey=SYNGDIBHUPXIQA-QZTNRIJFSA-N

SMILES: O=C1[C@@]2(OC=3C1=C(OC)C=C(O)C3Cl)C(OC)=CC(=O)C[C@H]2C

Synonyms:

• (1′S,6′R)-7-Chloro-6-hydroxy-2′,4-dimethoxy-6′-methylspiro[benzofuran-2(3H),1′-[2]cyclohexene]-3,4′-dione
• (2S,5′R)-7-Chloro-6-hydroxy-3′,4-dimethoxy-5′-methylspiro[benzofuran-2,4′-cyclohex-2-ene]-1′,3-dione
• 6-Demethylgriseofulvin
• 6-Desmethylgriseofulvin
• 6-O-Desmethylgriseofulvin
• Spiro[benzofuran-2(3H),1′-[2]cyclohexene]-3,4′-dione, 7-chloro-6-hydroxy-2′,4-dimethoxy-6′-methyl-, (1′S,6′R)-
• Spiro[benzofuran-2(3H),1′-[2]cyclohexene]-3,4′-dione, 7-chloro-6-hydroxy-2′,4-dimethoxy-6′-methyl-, (1′S-trans)-
• spiro[benzofuran-2(3H),1'-cyclohex[2]ene]-3,4'-dione, 7-chloro-6-hydroxy-2',4-dimethoxy-6'-methyl-
• 7-Chloro-6-hydroxy-2',4-dimethoxy-6'-methyl-3H,4'H-spiro[1-benzofuran-2,1'-cyclohex[2]ene]-3,4'-dione

6-O-Demethyl Griseofulvin

CAS: 20168-88-1

6-O-demethyl Griseofulvin is a metabolite of the antifungal griseofulvin .1,2

Formula: C₁₆H₁₅ClO₆

Color and Shape: Solid

Molecular weight: 338.74

Ref: TM-T36873

Griseofulvin Impurity 1

CAS: 20168-88-1

Formula: C₁₆H₁₅ClO₆

Molecular weight: 338.74

Ref: 4Z-G-087

6-O-Demethyl Griseofulvin

Controlled Product

CAS: 20168-88-1

Applications A metabolite of Griseofulvin (G787500).
References Oda, T., et al.: J. Antibiot., 59, 114 (2006), Rebacz, B., et al.: Cancer Res., 67, 6342 (2007), Uen, Y., et al.: J. Cell Biochem., 101, 1165 (2007),

Formula: C₁₆H₁₅ClO₆

Color and Shape: Neat

Molecular weight: 338.74

Ref: TR-D231080