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Murcko scaffold

Ring system with 3 rings and 24 atoms

5 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
24
Chemicals
5
With full pages
4
Scaffold SMILES

O=C(CN1C(=O)C2CC=CCC2C1=O)OCC(=O)c1ccccc1

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=C(CN1C(=O)C2CC=CCC2C1=O)OCC(=O)c1ccccc1

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 5 of 5 chemicals

2-(3,4-Dimethylphenyl)-2-oxoethyl (1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)acetate chemical structure, C20H21NO5, CAS 352672-11-8
2-(3,4-Dimethylphenyl)-2-oxoethyl (1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)acetate
CAS 352672-11-8C20H21NO5
2-(4-Chloro-3-nitrophenyl)-2-oxoethyl (1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)acetate chemical structure, C18H15ClN2O7, CAS 6436-79-9
2-(4-Chloro-3-nitrophenyl)-2-oxoethyl (1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)acetate
CAS 6436-79-9C18H15ClN2O7
2-(4-Methoxyphenyl)-2-oxoethyl (1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)acetate chemical structure, C19H19NO6, CAS 348115-53-7
2-(4-Methoxyphenyl)-2-oxoethyl (1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)acetate
CAS 348115-53-7C19H19NO6
[2-(2,4-Dimethoxyphenyl)-2-oxoethyl] 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetate chemical structure, C20H21NO7, CAS 851912-28-2
[2-(2,4-Dimethoxyphenyl)-2-oxoethyl] 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetate
CAS 851912-28-2C20H21NO7
[2-(2-Methoxyphenyl)-2-oxoethyl] 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetate chemical structure, C19H19NO6, CAS 1031100-94-3
[2-(2-Methoxyphenyl)-2-oxoethyl] 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetate
CAS 1031100-94-3C19H19NO6