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Murcko scaffold

Bicyclo[3.1.1]hept-3-en-2-one scaffold

13 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
8
Chemicals
13
With full pages
4
Scaffold SMILES

O=C1C=CC2CC1C2

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 Bicyclo[3.1.1]hept-3-en-2-one page
Murcko scaffold O=C1C=CC2CC1C2

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 13 of 13 chemicals

4,6,6-Trimethylbicyclo(3.1.1)hept-3-en-2-one chemical structure, C10H14O, CAS 5480-12-6
4,6,6-Trimethylbicyclo(3.1.1)hept-3-en-2-one
CAS 5480-12-6C10H14O
Verbenone, (A+-)- chemical structure, C10H14O, CAS 18309-32-5
Verbenone, (A+-)-
CAS 18309-32-5C10H14O
Levoverbenone chemical structure, C10H14O, CAS 1196-01-6
Levoverbenone
CAS 1196-01-6C10H14O
Bicyclo(3.1.1)hept-3-en-2-one, 6,6-dimethyl- chemical structure, C9H12O, CAS 70223-28-8
Bicyclo(3.1.1)hept-3-en-2-one, 6,6-dimethyl-
CAS 70223-28-8C9H12O
[(1S,5R)-6,6-Dimethyl-4-oxo-2-bicyclo[3.1.1]hept-2-enyl]methyl 2,2-dimethylpropanoate chemical structure, C15H22O3, CAS 113473-32-8
[(1S,5R)-6,6-Dimethyl-4-oxo-2-bicyclo[3.1.1]hept-2-enyl]methyl 2,2-dimethylpropanoate
CAS 113473-32-8C15H22O3
[(1R,5R)-6,6-Dimethyl-4-oxo-2-bicyclo[3.1.1]hept-2-enyl]methyl 2,2-dimethylpropanoate chemical structure, C15H22O3, CAS 76163-96-7
[(1R,5R)-6,6-Dimethyl-4-oxo-2-bicyclo[3.1.1]hept-2-enyl]methyl 2,2-dimethylpropanoate
CAS 76163-96-7C15H22O3
(1R,5R)-6,6-Dimethylbicyclo[3.1.1]hept-3-en-2-one chemical structure, C9H12O, CAS 35408-03-8
(1R,5R)-6,6-Dimethylbicyclo[3.1.1]hept-3-en-2-one
CAS 35408-03-8C9H12O
(1S)-6,6-Dimethylbicyclo(3.1.1)hept-3-en-2-one chemical structure, C9H12O, CAS 52691-72-2
(1S)-6,6-Dimethylbicyclo(3.1.1)hept-3-en-2-one
CAS 52691-72-2C9H12O
3-Fluoro-6,6-dimethylbicyclo[3.1.1]hept-3-en-2-one chemical structure, C9H11FO, CAS 165555-20-4
3-Fluoro-6,6-dimethylbicyclo[3.1.1]hept-3-en-2-one
CAS 165555-20-4C9H11FO
5,6,6-Trimethylbicyclo[3.1.1]hept-3-en-2-one chemical structure, C10H14O, CAS 88874-30-0
5,6,6-Trimethylbicyclo[3.1.1]hept-3-en-2-one
CAS 88874-30-0C10H14O
Bicyclo[3.1.1]hept-3-en-2-one chemical structure, C7H8O, CAS 39799-12-7
Bicyclo[3.1.1]hept-3-en-2-one
CAS 39799-12-7C7H8O
(6,6-Dimethyl-4-oxobicyclo[3.1.1]hept-2-en-2-yl)methyl acetate chemical structure, C12H16O3, CAS 62742-68-1
(6,6-Dimethyl-4-oxobicyclo[3.1.1]hept-2-en-2-yl)methyl acetate
CAS 62742-68-1C12H16O3
(1S,5R)-4-(Bromomethyl)-6,6-dimethylbicyclo[3.1.1]hept-3-en-2-one chemical structure, C10H13BrO, CAS 1474016-55-1
(1S,5R)-4-(Bromomethyl)-6,6-dimethylbicyclo[3.1.1]hept-3-en-2-one
CAS 1474016-55-1C10H13BrO