6-O-Demethyl Griseofulvin structure

6-O-Demethyl Griseofulvin

(2S,5'R)-7-chloro-6-hydroxy-3',4-dimethoxy-5'-methylspiro[1-benzofuran-2,4'-cyclohex-2-ene]-1',3-dione

Also Known As: 6-O-Demethyl Griseofulvin|6-Demethylgriseofulvin|6-Desmethylgriseofulvin|6-Desmethyl-griseofulvin|6-O-Demethylgriseofulvin|Demethylgriseofulvin, 6-O-|HY-W741491|(1'S,6'R)-7-Chloro-6-hydroxy-2',6-dimethoxy-6'-methylspiro[benzofuran-2(3H),1'-[2]cyclohexene]-3,4'-dione|(1'S-trans)-7-Chloro-6-hydroxy-2',4-dimethoxy-6'-methylspiro(benzofuran-2(3H),1'-(2)cyclohexen e)-3,4'-dione|(1'S,6'R)-7-chloro-6-hydroxy-2',4-dimethoxy-6'-methyl-3H-spiro[benzofuran-2,1'-cyclohex[2]ene]-3,4'-dione|(1'S,6'R)-7-Chloro-6-hydroxy-2',4-dimethoxy-6'-methylspiro(benzofuran-2(3H),1'-(2)cyclohexene)-3,4'-dione|(1'S,6'R)-7-Chloro-6-hydroxy-2',6-dimethoxy-6'-methylspiro[benzofuran-2(3H),1'-[2]cyclohexene]-3,4'-dione; (1'S-trans)- 7-Chloro-6-hydroxy-2',6-dimethoxy-6'-methylspiro|(1'S-trans)- 7-Chloro-6-hydroxy-2',6-dimethoxy-6'-methylspiro[benzofuran-2(3H),1'-[2]cyclohexene]-3,4'-dione|(2S,5'R)-7-chloro-6-hydroxy-3',4-dimethoxy-5'-methyl-spiro[benzofuran-2,4'-cyclohex-2-ene]-1',3-dione|(2S,5'R)-7-chloro-6-hydroxy-3',4-dimethoxy-5'-methylspiro[1-benzofuran-2,4'-cyclohex-2-ene]-1',3-dione|(2S,5'R)-7-chloro-6-hydroxy-3',4-dimethoxy-5'-methylspiro[1-benzouran-2,4'-cyclohex-2-ene]-1',3-dione|(2S,6 R)-2 ,4-Dimethoxy-6-hydroxy-6 beta-methyl-7-chlorospiro[benzofuran-2(3H),1 -[2]cyclohexene]-3,4 -dione|(2S,6 R)-7-Chloro-6-hydroxy-2 ,4-dimethoxy-6 -methylspiro[benzofuran-2(3H),1 -[2]cyclohexene]-3,4 -dione|(2S,6'R)-7-chloro-6-hydroxy-2',4-dimethoxy-6'-methyl-3H-spiro[1-benzofuran-2,1'-cyclohexan]-2'-ene-3,4'-dione|1'S,6'R)-7-CHLORO-6-HYDROXY-2',4-DIMETHOXY-6'-METHYLSPIRO(BENZOFURAN-2(3H),1'-(2)CYCLOHEXENE)-3,4'-DIONE|7-chloro-6-hydroxy-2',4-dimethoxy-6'-methyl-3H-spiro(1-benzofuran-2,1'-cyclohexan)-2'-ene-3,4'-dione|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'-[2]cyclohexene]-3,4'-dione, 7-chloro-6-hydroxy-2',4-dimethoxy-6'-methyl-, (1'S-trans)-

CAS: 20168-89-2
Molecular Formula C16H15ClO6
Molecular Weight 338.05573 g/mol
LogP 2.5073
Topological Polar Surface Area 82.06 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 2
Exact Mass 338.05573
Monoisotopic Mass 338.05573
Heavy Atoms 23
Complexity 753.4276

Chemical Identifiers

CAS Number 20168-89-2
SMILES C[C@@H]1CC(=O)C=C([C@]12C(=O)C3=C(C=C(C(=C3O2)Cl)O)OC)OC

Product Overview

6-O-Demethyl Griseofulvin (CAS 20168-89-2), with molecular formula C16H15ClO6 and molecular weight 338.05573 g/mol. IUPAC: (2S,5'R)-7-chloro-6-hydroxy-3',4-dimethoxy-5'-methylspiro[1-benzofuran-2,4'-cyclohex-2-ene]-1',3-dione.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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