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Murcko scaffold

Ring system with 3 rings and 16 atoms

8 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
16
Chemicals
8
With full pages
1
Scaffold SMILES

O=C1C=CCCC12Oc1ccccc1C2=O

A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.

Substructure search with this scaffold
Murcko scaffold O=C1C=CCCC12Oc1ccccc1C2=O

Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.

Chemicals with this scaffold

Open one to see its structure, properties and suppliers.

Showing 1 to 8 of 8 chemicals

Spiro(benzofuran-2(3H),1'-(3)cyclohexene)-2',3-dione, 7-chloro-4,6-dimethoxy-6'-methyl-, (1'S-trans)- chemical structure, C16H15ClO5, CAS 55658-69-0
Spiro(benzofuran-2(3H),1'-(3)cyclohexene)-2',3-dione, 7-chloro-4,6-dimethoxy-6'-methyl-, (1'S-trans)-
CAS 55658-69-0C16H15ClO5
Isogriseofulvin chemical structure, C17H17ClO6, CAS 469-52-3
Isogriseofulvin
CAS 469-52-3C17H17ClO6
7-Chloro-4'-ethoxy-4,6-dimethoxy-6'-methyl-3H-spiro[[1]benzofuran-2,1'-cyclohex[3]ene]-2',3-dione chemical structure, C18H19ClO6, CAS 3260-52-4
7-Chloro-4'-ethoxy-4,6-dimethoxy-6'-methyl-3H-spiro[[1]benzofuran-2,1'-cyclohex[3]ene]-2',3-dione
CAS 3260-52-4C18H19ClO6
7-Chloro-4,6-dimethoxy-6'-methyl-4'-propoxy-3H-spiro[[1]benzofuran-2,1'-cyclohex[3]ene]-2',3-dione chemical structure, C19H21ClO6, CAS 65267-25-6
7-Chloro-4,6-dimethoxy-6'-methyl-4'-propoxy-3H-spiro[[1]benzofuran-2,1'-cyclohex[3]ene]-2',3-dione
CAS 65267-25-6C19H21ClO6
4'-Butoxy-7-chloro-4,6-dimethoxy-6'-methyl-3H-spiro[[1]benzofuran-2,1'-cyclohex[3]ene]-2',3-dione chemical structure, C20H23ClO6, CAS 65267-27-8
4'-Butoxy-7-chloro-4,6-dimethoxy-6'-methyl-3H-spiro[[1]benzofuran-2,1'-cyclohex[3]ene]-2',3-dione
CAS 65267-27-8C20H23ClO6
Spiro[benzofuran-2(3H),1'-cyclohex[3]ene]-2',3-dione, 7-chloro-4'-(hexyloxy)-4,6-dimethoxy-6'-methyl- chemical structure, C22H27ClO6, CAS 101919-82-8
Spiro[benzofuran-2(3H),1'-cyclohex[3]ene]-2',3-dione, 7-chloro-4'-(hexyloxy)-4,6-dimethoxy-6'-methyl-
CAS 101919-82-8C22H27ClO6
4,4',6-Trimethoxy-6'-methyl-3'-grisen-2',3-dione chemical structure, C17H18O6, CAS 56783-97-2
4,4',6-Trimethoxy-6'-methyl-3'-grisen-2',3-dione
CAS 56783-97-2C17H18O6
4'-Demethoxy-4'-N-isopentylisogriseofulvin chemical structure, C21H26ClNO5, CAS 2088983-08-6
4'-Demethoxy-4'-N-isopentylisogriseofulvin
CAS 2088983-08-6C21H26ClNO5