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Murcko scaffold

Ring system with 5 rings and 26 atoms

36 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
26
Chemicals
36
With full pages
9
Scaffold SMILES

O=C(OC1CCC2C(=CCC3C4CCCC4CCC23)C1)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(OC1CCC2C(=CCC3C4CCCC4CCC23)C1)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 36 of 36 chemicals

Cholest-5-en-3beta-yl p-chlorobenzoate chemical structure, C34H49ClO2, CAS 22575-27-5
Cholest-5-en-3beta-yl p-chlorobenzoate
CAS 22575-27-5C34H49ClO2
Cholesteryl 4-fluorobenzoate chemical structure, C34H49NO4, CAS 23838-12-2
Cholesteryl 4-fluorobenzoate
CAS 23838-12-2C34H49NO4
(3beta)-Stigmast-5-en-3-yl benzoate chemical structure, C36H54O2, CAS 1900-52-3
(3beta)-Stigmast-5-en-3-yl benzoate
CAS 1900-52-3C36H54O2
Cholesteryl hydrogen phthalate chemical structure, C35H50O4, CAS 6732-01-0
Cholesteryl hydrogen phthalate
CAS 6732-01-0C35H50O4
[(3S,8S,10R,13R,14S,17R)-10,13-Dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2,4-dichlorobenzoate chemical structure, C34H48Cl2O2
[(3S,8S,10R,13R,14S,17R)-10,13-Dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2,4-dichlorobenzoate
C34H48Cl2O2
Cholesteryl 2,6-dimethyl-3-iodobenzoate chemical structure, C36H53IO2, CAS 124784-15-2
Cholesteryl 2,6-dimethyl-3-iodobenzoate
CAS 124784-15-2C36H53IO2
Pregnenolone 2,6-dimethyl-3-iodobenzoate chemical structure, C30H39IO3, CAS 124784-16-3
Pregnenolone 2,6-dimethyl-3-iodobenzoate
CAS 124784-16-3C30H39IO3
[10,13-Dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-hydroxybenzoate chemical structure, C34H50O3, CAS 7461-18-9
[10,13-Dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-hydroxybenzoate
CAS 7461-18-9C34H50O3
7|A-hydroxycholesterol 3|A-benzoate chemical structure, C34H50O3
7|A-hydroxycholesterol 3|A-benzoate
C34H50O3
Cholesteryl benzoate chemical structure, C34H50O2, CAS 604-32-0
Cholesteryl benzoate
CAS 604-32-0C34H50O2
Cholesteryl 2,4-diclorobenzoate chemical structure, C34H48Cl2O2
Cholesteryl 2,4-diclorobenzoate
C34H48Cl2O2
Isospinasterol, P-nitrobenzoate chemical structure, C34H47NO4, CAS 7505-35-3
Isospinasterol, P-nitrobenzoate
CAS 7505-35-3C34H47NO4
Cholest-5-en-3beta-yl p-ethoxybenzoate chemical structure, C36H54O3, CAS 41484-50-8
Cholest-5-en-3beta-yl p-ethoxybenzoate
CAS 41484-50-8C36H54O3
Cholest-5-en-3beta-yl p-butoxybenzoate chemical structure, C38H58O3, CAS 41484-52-0
Cholest-5-en-3beta-yl p-butoxybenzoate
CAS 41484-52-0C38H58O3
Cholesteryl dichlorobenzoate chemical structure, C34H48Cl2O2, CAS 32832-01-2
Cholesteryl dichlorobenzoate
CAS 32832-01-2C34H48Cl2O2
(3b,7a)-Cholest-5-ene-3,7-diol 3-Benzoate chemical structure, C34H50O3
(3b,7a)-Cholest-5-ene-3,7-diol 3-Benzoate
C34H50O3
[(3S,8R,9S,10R,13R,14R,17R)-10,13-Dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2,4-dichlorobenzoate chemical structure, C34H48Cl2O2
[(3S,8R,9S,10R,13R,14R,17R)-10,13-Dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2,4-dichlorobenzoate
C34H48Cl2O2
Cholesteryl 4-(allyloxy)benzoate chemical structure, C37H54O3, CAS 83953-73-5
Cholesteryl 4-(allyloxy)benzoate
CAS 83953-73-5C37H54O3
17-Acetoxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl benzoate chemical structure, C28H36O4, CAS 188175-90-8
17-Acetoxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl benzoate
CAS 188175-90-8C28H36O4
Cholest-5-en-3-ol (3beta)-, 2-(acetyloxy)benzoate chemical structure, C36H52O4
Cholest-5-en-3-ol (3beta)-, 2-(acetyloxy)benzoate
C36H52O4
Cholesteryl 3,5-dinitrobenzoate chemical structure, C34H48N2O6, CAS 25279-63-4
Cholesteryl 3,5-dinitrobenzoate
CAS 25279-63-4C34H48N2O6
Cholest-5-en-3-ol (3b)-, 3,4-dichlorobenzoate chemical structure, C34H48Cl2O2
Cholest-5-en-3-ol (3b)-, 3,4-dichlorobenzoate
C34H48Cl2O2
5-Cholestene-3beta,7beta-diol 3-benzoate chemical structure, C34H50O3, CAS 17974-80-0
5-Cholestene-3beta,7beta-diol 3-benzoate
CAS 17974-80-0C34H50O3
Androst-5-ene-3-beta,17-beta-diol, 17-methyl-, 3-phthalate, monosodium salt chemical structure, C28H35NaO5, CAS 101831-48-5
Androst-5-ene-3-beta,17-beta-diol, 17-methyl-, 3-phthalate, monosodium salt
CAS 101831-48-5C28H35NaO5