CompoundList
Sign in
Murcko scaffold

Ring system with 3 rings and 19 atoms

12 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
19
Chemicals
12
With full pages
2
Scaffold SMILES

O=C1CCCC(CCC2CC=CC3CCCCC32)O1

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=C1CCCC(CCC2CC=CC3CCCCC32)O1

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 12 of 12 chemicals

Dihydrocompactin chemical structure, C23H36O5, CAS 78366-44-6
Dihydrocompactin
CAS 78366-44-6C23H36O5
Dihydromevinolin chemical structure, C24H38O5, CAS 77517-29-4
Dihydromevinolin
CAS 77517-29-4C24H38O5
4-tert-Butyldimethylsilyl-4a'-hydroxy Simvastatin chemical structure, C31H54O6Si, CAS 125142-16-7
4-tert-Butyldimethylsilyl-4a'-hydroxy Simvastatin
CAS 125142-16-7C31H54O6Si
4-tert-Butyldimethylsilyl-5'-chloro-4a'-hydroxy Simvastatin chemical structure, C31H53ClO6Si, CAS 123852-10-8
4-tert-Butyldimethylsilyl-5'-chloro-4a'-hydroxy Simvastatin
CAS 123852-10-8C31H53ClO6Si
Des-2-Methylbutanoyl Chloride tert-Butyldimethylsilyl Ether 4a,5-Dihydro Lovastatin chemical structure, C25H44O4Si, CAS 120417-22-3
Des-2-Methylbutanoyl Chloride tert-Butyldimethylsilyl Ether 4a,5-Dihydro Lovastatin
CAS 120417-22-3C25H44O4Si
tert-Butyldimethylsilyl Ether 4a,5-Dihydro Lovastatin chemical structure, C30H52O5Si, CAS 85648-17-5
tert-Butyldimethylsilyl Ether 4a,5-Dihydro Lovastatin
CAS 85648-17-5C30H52O5Si
(4R,6R)-Tetrahydro-4-hydroxy-6-(2-((1S,2S,4aR,6R,8aS)-1,2,4a,5,6,7,8,8a-octahydro-2,6-dimethyl-1-naphthalenyl)ethyl)-2H-pyran-2-one chemical structure, C19H30O3, CAS 86827-77-2
(4R,6R)-Tetrahydro-4-hydroxy-6-(2-((1S,2S,4aR,6R,8aS)-1,2,4a,5,6,7,8,8a-octahydro-2,6-dimethyl-1-naphthalenyl)ethyl)-2H-pyran-2-one
CAS 86827-77-2C19H30O3
4-tert-Butyldimethylsilyl-5'-chloro-4a'-hydroxy-6'-(hydroxyimino)methyl Simvastatin chemical structure, C31H52ClNO7Si, CAS 123852-22-2
4-tert-Butyldimethylsilyl-5'-chloro-4a'-hydroxy-6'-(hydroxyimino)methyl Simvastatin
CAS 123852-22-2C31H52ClNO7Si
[8-[2-[4-[tert-Butyl(dimethyl)silyl]oxy-6-oxooxan-2-yl]ethyl]-4a-hydroxy-3,7-dimethyl-2,3,4,7,8,8a-hexahydro-1H-naphthalen-1-yl] 2,2-dimethylbutanoate chemical structure, C31H54O6Si
[8-[2-[4-[tert-Butyl(dimethyl)silyl]oxy-6-oxooxan-2-yl]ethyl]-4a-hydroxy-3,7-dimethyl-2,3,4,7,8,8a-hexahydro-1H-naphthalen-1-yl] 2,2-dimethylbutanoate
C31H54O6Si
[(1S,3R,4aS,7S,8S,8aR)-8-[2-[(2R,4R)-4-[tert-Butyl(dimethyl)silyl]oxy-6-oxooxan-2-yl]ethyl]-4a-hydroxy-3,7-dimethyl-2,3,4,7,8,8a-hexahydro-1H-naphthalen-1-yl] 2,2-dimethylbutanoate chemical structure, C31H54O6Si
[(1S,3R,4aS,7S,8S,8aR)-8-[2-[(2R,4R)-4-[tert-Butyl(dimethyl)silyl]oxy-6-oxooxan-2-yl]ethyl]-4a-hydroxy-3,7-dimethyl-2,3,4,7,8,8a-hexahydro-1H-naphthalen-1-yl] 2,2-dimethylbutanoate
C31H54O6Si
Simvastatin EP impurity K chemical structure, C25H40O5, CAS 2731620-64-5
Simvastatin EP impurity K
CAS 2731620-64-5C25H40O5
[(4aS)-8-[2-[4-[tert-Butyl(dimethyl)silyl]oxy-6-oxooxan-2-yl]ethyl]-4a-hydroxy-3,7-dimethyl-2,3,4,7,8,8a-hexahydro-1H-naphthalen-1-yl] 2,2-dimethylbutanoate chemical structure, C31H54O6Si
[(4aS)-8-[2-[4-[tert-Butyl(dimethyl)silyl]oxy-6-oxooxan-2-yl]ethyl]-4a-hydroxy-3,7-dimethyl-2,3,4,7,8,8a-hexahydro-1H-naphthalen-1-yl] 2,2-dimethylbutanoate
C31H54O6Si