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Murcko scaffold

1,3-Dioxane-4,6-dione scaffold

80 chemicals on CompoundList share this ring system.

Rings
1
Scaffold atoms
8
Chemicals
80
With full pages
7
Scaffold SMILES

O=C1CC(=O)OCO1

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 scaffoldOpen the 1,3-Dioxane-4,6-dione page
Murcko scaffold O=C1CC(=O)OCO1

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 48 of 80 chemicals

2,2-Dimethyl-1,3-dioxane-4,6-dione chemical structure, C6H8O4, CAS 2033-24-1
2,2-Dimethyl-1,3-dioxane-4,6-dione
CAS 2033-24-1C6H8O4
2,2,5-Trimethyl-1,3-dioxane-4,6-dione chemical structure, C7H10O4, CAS 3709-18-0
2,2,5-Trimethyl-1,3-dioxane-4,6-dione
CAS 3709-18-0C7H10O4
5,5-Diethyl-2,2-dipropyl-1,3-dioxane-4,6-dione chemical structure, C14H24O4, CAS 5408-18-4
5,5-Diethyl-2,2-dipropyl-1,3-dioxane-4,6-dione
CAS 5408-18-4C14H24O4
1,3-Dioxane-4,6-dione chemical structure, C4H4O4, CAS 4354-85-2
1,3-Dioxane-4,6-dione
CAS 4354-85-2C4H4O4
2,2-Dimethyl-5-(2-oxopropyl)-1,3-dioxane-4,6-dione chemical structure, C9H12O5, CAS 77228-15-0
2,2-Dimethyl-5-(2-oxopropyl)-1,3-dioxane-4,6-dione
CAS 77228-15-0C9H12O5
5-Octanoyl-2,2-dimethyl-1,3-dioxane-4,6-dione chemical structure, C14H22O5, CAS 103576-44-9
5-Octanoyl-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS 103576-44-9C14H22O5
2,2,5,5-Tetramethyl-1,3-dioxane-4,6-dione chemical structure, C8H12O4, CAS 15568-97-5
2,2,5,5-Tetramethyl-1,3-dioxane-4,6-dione
CAS 15568-97-5C8H12O4
5,5-Dichloro-2,2-dimethyl-1,3-dioxane-4,6-dione chemical structure, C6H6Cl2O4, CAS 477558-77-3
5,5-Dichloro-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS 477558-77-3C6H6Cl2O4
5-Bromo-2,2,5-trimethyl-1,3-dioxane-4,6-dione chemical structure, C7H9BrO4, CAS 34817-42-0
5-Bromo-2,2,5-trimethyl-1,3-dioxane-4,6-dione
CAS 34817-42-0C7H9BrO4
5-(2-Chloroacetyl)-2,2-dimethyl-1,3-dioxane-4,6-dione chemical structure, C8H9ClO5, CAS 505048-19-1
5-(2-Chloroacetyl)-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS 505048-19-1C8H9ClO5
5-[(Dimethylamino)methyl]-2,2-dimethyl-1,3-dioxane-4,6-dione chemical structure, C9H15NO4, CAS 227201-29-8
5-[(Dimethylamino)methyl]-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS 227201-29-8C9H15NO4
2-tert-Butyl-2-methyl-1,3-dioxane-4,6-dione chemical structure, C9H14O4, CAS 62018-49-9
2-tert-Butyl-2-methyl-1,3-dioxane-4,6-dione
CAS 62018-49-9C9H14O4
5-Acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione chemical structure, C8H10O5, CAS 72324-39-1
5-Acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS 72324-39-1C8H10O5
2,2-Dimethyl-5,5-di(prop-2-yn-1-yl)-1,3-dioxane-4,6-dione chemical structure, C12H12O4, CAS 145544-03-2
2,2-Dimethyl-5,5-di(prop-2-yn-1-yl)-1,3-dioxane-4,6-dione
CAS 145544-03-2C12H12O4
2,2-Dimethyl-5-nitro-1,3-dioxane-4,6-dione chemical structure, C6H7NO6, CAS 686276-83-5
2,2-Dimethyl-5-nitro-1,3-dioxane-4,6-dione
CAS 686276-83-5C6H7NO6
5-Ethyl-2,2-dimethyl-1,3-dioxane-4,6-dione chemical structure, C8H12O4, CAS 17216-65-8
5-Ethyl-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS 17216-65-8C8H12O4
Meldrum's acid-13C chemical structure, C6H8O4, CAS 123254-02-4
Meldrum's acid-13C
CAS 123254-02-4C6H8O4
2,2-Dimethyl-5-propanoyl-1,3-dioxane-4,6-dione chemical structure, C9H12O5, CAS 64074-05-1
2,2-Dimethyl-5-propanoyl-1,3-dioxane-4,6-dione
CAS 64074-05-1C9H12O5
tert-Butyl (2S)-4-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoate chemical structure, C19H29NO9, CAS 710950-77-9
tert-Butyl (2S)-4-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoate
CAS 710950-77-9C19H29NO9
1,3-Dioxane-4,6-dione, 5,5-diethyl-2,2-dimethyl- chemical structure, C10H16O4, CAS 39623-07-9
1,3-Dioxane-4,6-dione, 5,5-diethyl-2,2-dimethyl-
CAS 39623-07-9C10H16O4
5-Fluoro-2,2-dimethyl-1,3-dioxane-4,6-dione chemical structure, C6H7FO4, CAS 187837-96-3
5-Fluoro-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS 187837-96-3C6H7FO4
5-Decanoyl-2,2-dimethyl-1,3-dioxane-4,6-dione chemical structure, C16H26O5, CAS 182359-65-5
5-Decanoyl-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS 182359-65-5C16H26O5
1,3-Dioxane-4,6-dione, 2,2-dimethyl-5-(3-oxobutyl)- chemical structure, C10H14O5, CAS 90734-82-0
1,3-Dioxane-4,6-dione, 2,2-dimethyl-5-(3-oxobutyl)-
CAS 90734-82-0C10H14O5
5-Butyl-2,2-dimethyl-1,3-dioxane-4,6-dione chemical structure, C10H16O4, CAS 57742-51-5
5-Butyl-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS 57742-51-5C10H16O4