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Murcko scaffold

Ring system with 5 rings and 17 atoms

26 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
17
Chemicals
26
With full pages
1
Scaffold SMILES

C1CC2CCC3C(CCC45CC4CCC35)C2C1

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 C1CC2CCC3C(CCC45CC4CCC35)C2C1

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 26 of 26 chemicals

(3alpha,5R,6beta)-6-Methoxy-3,5-cyclocholestane chemical structure, C28H48O, CAS 2867-93-8
(3alpha,5R,6beta)-6-Methoxy-3,5-cyclocholestane
CAS 2867-93-8C28H48O
(3beta,5alpha,6alpha)-3,5-Cyclocholestan-6-ol chemical structure, C27H46O, CAS 508-41-8
(3beta,5alpha,6alpha)-3,5-Cyclocholestan-6-ol
CAS 508-41-8C27H46O
3,5-Cyclopregn-20-yne-6,17-diol chemical structure, C21H30O2
3,5-Cyclopregn-20-yne-6,17-diol
C21H30O2
3,5-Cyclocholestane chemical structure, C27H46, CAS 17132-01-3
3,5-Cyclocholestane
CAS 17132-01-3C27H46
6-Ethynyl-3a,5a-dimethylhexadecahydrocyclopenta(a)cyclopropa(2,3)cyclopenta(1,2-f)naphthalene-6,10-diol chemical structure, C21H30O2, CAS 7253-33-0
6-Ethynyl-3a,5a-dimethylhexadecahydrocyclopenta(a)cyclopropa(2,3)cyclopenta(1,2-f)naphthalene-6,10-diol
CAS 7253-33-0C21H30O2
(22E)-6beta-Methoxy-3beta,5alpha-cyclostigmast-22-ene chemical structure, C30H50O
(22E)-6beta-Methoxy-3beta,5alpha-cyclostigmast-22-ene
C30H50O
3,5-Cyclostigmast-22-ene, 6-methoxy-, (3beta,5alpha,6beta,22E)- chemical structure, C30H50O
3,5-Cyclostigmast-22-ene, 6-methoxy-, (3beta,5alpha,6beta,22E)-
C30H50O
(1S,2R,5S,7R,8R,10S,11S,14R,15R)-14-[(E,2R,5S)-5-Ethyl-6-methylhept-3-en-2-yl]-8-methoxy-2,15-dimethylpentacyclo[8.7.0.02,7.05,7.011,15]heptadecane chemical structure, C30H50O
(1S,2R,5S,7R,8R,10S,11S,14R,15R)-14-[(E,2R,5S)-5-Ethyl-6-methylhept-3-en-2-yl]-8-methoxy-2,15-dimethylpentacyclo[8.7.0.02,7.05,7.011,15]heptadecane
C30H50O
3,5-Cyclo-5alpha,17alpha-pregn-20-yne-6beta,17-diol chemical structure, C21H30O2
3,5-Cyclo-5alpha,17alpha-pregn-20-yne-6beta,17-diol
C21H30O2
Cyclopregnol chemical structure, C21H32O2, CAS 465-53-2
Cyclopregnol
CAS 465-53-2C21H32O2
i-Cholesterol chemical structure, C27H46O, CAS 465-54-3
i-Cholesterol
CAS 465-54-3C27H46O
(2S)-2-[(1S,2R,5R,7R,8R,10S,11S,14R,15S)-8-Methoxy-2,15-dimethyl-14-pentacyclo[8.7.0.02,7.05,7.011,15]heptadecanyl]propanal chemical structure, C23H36O2, CAS 25819-77-6
(2S)-2-[(1S,2R,5R,7R,8R,10S,11S,14R,15S)-8-Methoxy-2,15-dimethyl-14-pentacyclo[8.7.0.02,7.05,7.011,15]heptadecanyl]propanal
CAS 25819-77-6C23H36O2
(3beta,5alpha,6beta,22E)-3,5-Cyclostigmast-22-ene 6-Methyl Ether chemical structure, C30H50O, CAS 53603-94-4
(3beta,5alpha,6beta,22E)-3,5-Cyclostigmast-22-ene 6-Methyl Ether
CAS 53603-94-4C30H50O
(3S,4R,6R)-3-Ethyl-6-[(1S,2R,5R,7R,8R,10S,11S,14R,15R)-8-methoxy-2,15-dimethyl-14-pentacyclo[8.7.0.02,7.05,7.011,15]heptadecanyl]-2-methylheptan-4-ol chemical structure, C30H52O2, CAS 105644-48-2
(3S,4R,6R)-3-Ethyl-6-[(1S,2R,5R,7R,8R,10S,11S,14R,15R)-8-methoxy-2,15-dimethyl-14-pentacyclo[8.7.0.02,7.05,7.011,15]heptadecanyl]-2-methylheptan-4-ol
CAS 105644-48-2C30H52O2
(3beta,5alpha,6beta,22R,24R)-6-Methoxy-3,5-Cycloergostan-22-ol chemical structure, C29H50O2
(3beta,5alpha,6beta,22R,24R)-6-Methoxy-3,5-Cycloergostan-22-ol
C29H50O2
3,5-Cyclo-27-norcholestane-22,26-diol, 6-methoxy-, (3beta,5alpha,6beta,22R)- chemical structure, C27H46O3, CAS 92927-02-1
3,5-Cyclo-27-norcholestane-22,26-diol, 6-methoxy-, (3beta,5alpha,6beta,22R)-
CAS 92927-02-1C27H46O3
(2S)-2-[(1S,2R,5R,7R,8R,10S,11S,14R,15S)-8-Methoxy-2,15-dimethyl-14-pentacyclo[8.7.0.02,7.05,7.011,15]heptadecanyl]propan-1-ol chemical structure, C23H38O2, CAS 51231-23-3
(2S)-2-[(1S,2R,5R,7R,8R,10S,11S,14R,15S)-8-Methoxy-2,15-dimethyl-14-pentacyclo[8.7.0.02,7.05,7.011,15]heptadecanyl]propan-1-ol
CAS 51231-23-3C23H38O2
Vladimuliecin A chemical structure, C25H38O6, CAS 1154510-24-3
Vladimuliecin A
CAS 1154510-24-3C25H38O6
Vladimuliecin B chemical structure, C23H36O5, CAS 1154510-26-5
Vladimuliecin B
CAS 1154510-26-5C23H36O5
(3beta,5alpha,6beta,15alpha,17beta)-17-tert-Butyldimethylsilyloxy-6-methoxy-3,5-cycloandrostan-15-ol chemical structure, C26H46O3Si, CAS 61252-35-5
(3beta,5alpha,6beta,15alpha,17beta)-17-tert-Butyldimethylsilyloxy-6-methoxy-3,5-cycloandrostan-15-ol
CAS 61252-35-5C26H46O3Si
(1S,2R,5R,7R,8R,10R,11S,12S,14S,15S)-14-[tert-Butyl(dimethyl)silyl]oxy-8-methoxy-2,15-dimethylpentacyclo[8.7.0.02,7.05,7.011,15]heptadecan-12-ol chemical structure, C26H46O3Si
(1S,2R,5R,7R,8R,10R,11S,12S,14S,15S)-14-[tert-Butyl(dimethyl)silyl]oxy-8-methoxy-2,15-dimethylpentacyclo[8.7.0.02,7.05,7.011,15]heptadecan-12-ol
C26H46O3Si
14-(5,6-Dimethylheptan-2-yl)-8-methoxy-2,15-dimethylpentacyclo[8.7.0.02,7.05,7.011,15]heptadecane chemical structure, C29H50O, CAS 71496-86-1
14-(5,6-Dimethylheptan-2-yl)-8-methoxy-2,15-dimethylpentacyclo[8.7.0.02,7.05,7.011,15]heptadecane
CAS 71496-86-1C29H50O
14-[tert-Butyl(dimethyl)silyl]oxy-8-methoxy-2,15-dimethylpentacyclo[8.7.0.02,7.05,7.011,15]heptadecan-12-ol chemical structure, C26H46O3Si
14-[tert-Butyl(dimethyl)silyl]oxy-8-methoxy-2,15-dimethylpentacyclo[8.7.0.02,7.05,7.011,15]heptadecan-12-ol
C26H46O3Si
(3beta,5alpha,6beta,22R,24R)-6-Methoxy-3,5-Cycloergostan-22-ol chemical structure, C29H50O2, CAS 71473-15-9
(3beta,5alpha,6beta,22R,24R)-6-Methoxy-3,5-Cycloergostan-22-ol
CAS 71473-15-9C29H50O2