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Murcko scaffold

Ring system with 6 rings and 27 atoms

12 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
27
Chemicals
12
With full pages
2
Scaffold SMILES

O=C1C=CC2C(=C1)CCC1C2CCC2C1CC1OC(C3CCCCC3)OC12

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=C1C=CC2C(=C1)CCC1C2CCC2C1CC1OC(C3CCCCC3)OC12

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

(RS)-Ciclesonide chemical structure, C32H44O7, CAS 204444-45-1
(RS)-Ciclesonide
CAS 204444-45-1C32H44O7
Ciclesonide chemical structure, C32H44O7, CAS 126544-47-6
Ciclesonide
CAS 126544-47-6C32H44O7
Desisobutyryl-ciclesonide chemical structure, C28H38O6, CAS 161115-59-9
Desisobutyryl-ciclesonide
CAS 161115-59-9C28H38O6
Ciclesonide-impurity 1F4 chemical structure, C28H38O6, CAS 161115-60-2
Ciclesonide-impurity 1F4
CAS 161115-60-2C28H38O6
(1S,2S,4R,8S,9S,11S,12S,13R)-6-Cyclohexyl-11-hydroxy-8-(2-hydroxyacetyl)-9,13-dimethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one chemical structure, C28H38O6, CAS 204444-44-0
(1S,2S,4R,8S,9S,11S,12S,13R)-6-Cyclohexyl-11-hydroxy-8-(2-hydroxyacetyl)-9,13-dimethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one
CAS 204444-44-0C28H38O6
Ciclesonide 22S-epimer chemical structure, C32H44O7, CAS 141845-81-0
Ciclesonide 22S-epimer
CAS 141845-81-0C32H44O7
RefChem:1061400 chemical structure, C32H44O7, CAS 141845-82-1
RefChem:1061400
CAS 141845-82-1C32H44O7
Ciclesonide-d7 chemical structure, C32H44O7, CAS 1225382-70-6
Ciclesonide-d7
CAS 1225382-70-6C32H44O7
(11beta,16alpha)-21-Bromo-16,17-[[(R)-cyclohexylmethylene]bis(oxy)]-11-hydroxypregna-1,4-diene-3,20-dione chemical structure, C28H37BrO5, CAS 1451396-66-9
(11beta,16alpha)-21-Bromo-16,17-[[(R)-cyclohexylmethylene]bis(oxy)]-11-hydroxypregna-1,4-diene-3,20-dione
CAS 1451396-66-9C28H37BrO5
[2-[(8S,9S,13R)-6-Cyclohexyl-11-hydroxy-9,13-dimethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] 2-methylpropanoate chemical structure, C32H44O7
[2-[(8S,9S,13R)-6-Cyclohexyl-11-hydroxy-9,13-dimethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] 2-methylpropanoate
C32H44O7
(11beta)-16,17-[(Cyclohexylmethylene)bis(oxy)]-11-hydroxy-21-(2-methyl-1-oxopropoxy)pregna-1,4-diene-3,20-dione chemical structure, C32H44O7, CAS 848439-16-7
(11beta)-16,17-[(Cyclohexylmethylene)bis(oxy)]-11-hydroxy-21-(2-methyl-1-oxopropoxy)pregna-1,4-diene-3,20-dione
CAS 848439-16-7C32H44O7
Ciclesonide-impurity 1F3 chemical structure, C30H42O7, CAS 3035286-88-2
Ciclesonide-impurity 1F3
CAS 3035286-88-2C30H42O7