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Murcko scaffold

Ring system with 3 rings and 22 atoms

20 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 22
Chemicals: 20
With full pages: 4

Scaffold SMILES

O=C1CCCC=C1C(c1ccccc1)C1C(=O)CCCC1=O

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=C1C(c1ccccc1)C1C(=O)CCCC1=O

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 20 of 20 chemicals

2-[(2-Hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)(phenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione chemical structure, C23H28O4, CAS 293325-89-0

2-[(2-Hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)(phenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione

CAS 293325-89-0C₂₃H₂₈O₄

2-[(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)(2-hydroxy-3-methoxyphenyl)methyl]-5,5-dimethyl-1,3-cyclohexanedione chemical structure, C24H30O6, CAS 293325-97-0

2-[(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)(2-hydroxy-3-methoxyphenyl)methyl]-5,5-dimethyl-1,3-cyclohexanedione

CAS 293325-97-0C₂₄H₃₀O₆

2-[(4-Chlorophenyl)(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)methyl]-5,5-dimethyl-1,3-cyclohexanedione chemical structure, C23H27ClO4, CAS 316129-81-4

2-[(4-Chlorophenyl)(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)methyl]-5,5-dimethyl-1,3-cyclohexanedione

CAS 316129-81-4C₂₃H₂₇ClO₄

2-[(2-Hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-(2-hydroxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione chemical structure, C23H28O5, CAS 293761-38-3

2-[(2-Hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-(2-hydroxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione

CAS 293761-38-3C₂₃H₂₈O₅

2-[(2-Hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-(4-hydroxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione chemical structure, C23H28O5, CAS 315671-83-1

2-[(2-Hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-(4-hydroxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione

CAS 315671-83-1C₂₃H₂₈O₅

2-[(3,4-Dimethoxyphenyl)(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione chemical structure, C25H32O6, CAS 5105-26-0

2-[(3,4-Dimethoxyphenyl)(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione

CAS 5105-26-0C₂₅H₃₂O₆

2-[(2,4-Dichlorophenyl)(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione chemical structure, C23H26Cl2O4, CAS 315248-72-7

2-[(2,4-Dichlorophenyl)(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione

CAS 315248-72-7C₂₃H₂₆Cl₂O₄

2-[(2-Chlorophenyl)-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione chemical structure, C23H27ClO4, CAS 316134-45-9

2-[(2-Chlorophenyl)-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione

CAS 316134-45-9C₂₃H₂₇ClO₄

2-[(3,5-Dichloro-2-hydroxyphenyl)-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione chemical structure, C23H26Cl2O5, CAS 301208-15-1

2-[(3,5-Dichloro-2-hydroxyphenyl)-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione

CAS 301208-15-1C₂₃H₂₆Cl₂O₅

2-[(2-Hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)(3,4,5-trimethoxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione chemical structure, C26H34O7, CAS 315671-82-0

2-[(2-Hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)(3,4,5-trimethoxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione

CAS 315671-82-0C₂₆H₃₄O₇

2-[[4-(Diethylamino)-2-hydroxyphenyl]-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione chemical structure, C27H37NO5, CAS 304667-07-0

2-[[4-(Diethylamino)-2-hydroxyphenyl]-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione

CAS 304667-07-0C₂₇H₃₇NO₅

2-[(2-Hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-(3-hydroxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione chemical structure, C23H28O5, CAS 304455-40-1

2-[(2-Hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-(3-hydroxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione

CAS 304455-40-1C₂₃H₂₈O₅

2-{(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)[4-(methylsulfanyl)phenyl]methyl}-5,5-dimethyl-1,3-cyclohexanedione chemical structure, C24H30O4S, CAS 307339-56-6

2-{(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)[4-(methylsulfanyl)phenyl]methyl}-5,5-dimethyl-1,3-cyclohexanedione

CAS 307339-56-6C₂₄H₃₀O₄S

[4-[(4,4-Dimethyl-2,6-dioxocyclohexyl)-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-2-methoxyphenyl] acetate chemical structure, C26H32O7, CAS 316138-68-8

[4-[(4,4-Dimethyl-2,6-dioxocyclohexyl)-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-2-methoxyphenyl] acetate

CAS 316138-68-8C₂₆H₃₂O₇

2-[(2-Chloro-5-nitrophenyl)(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)methyl]-5,5-dimethyl-1,3-cyclohexanedione chemical structure, C23H26ClNO6, CAS 306324-82-3

2-[(2-Chloro-5-nitrophenyl)(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)methyl]-5,5-dimethyl-1,3-cyclohexanedione

CAS 306324-82-3C₂₃H₂₆ClNO₆

2-[(2-Hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)(3-methylphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione chemical structure, C24H30O4, CAS 303769-68-8

2-[(2-Hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)(3-methylphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione

CAS 303769-68-8C₂₄H₃₀O₄

2-[(2-Ethoxyphenyl)-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione chemical structure, C25H32O5, CAS 5315-19-5

2-[(2-Ethoxyphenyl)-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione

CAS 5315-19-5C₂₅H₃₂O₅

2-[(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)(2-methylphenyl)methyl]-5,5-dimethyl-1,3-cyclohexanedione chemical structure, C24H30O4, CAS 315672-61-8

2-[(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)(2-methylphenyl)methyl]-5,5-dimethyl-1,3-cyclohexanedione

CAS 315672-61-8C₂₄H₃₀O₄

2-[(4-Ethoxyphenyl)-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione chemical structure, C25H32O5, CAS 293325-92-5

2-[(4-Ethoxyphenyl)-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione

CAS 293325-92-5C₂₅H₃₂O₅

2-[(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)(3-methoxyphenyl)methyl]-5,5-dimethyl-1,3-cyclohexanedione chemical structure, C24H30O5, CAS 315675-72-0

2-[(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)(3-methoxyphenyl)methyl]-5,5-dimethyl-1,3-cyclohexanedione

CAS 315675-72-0C₂₄H₃₀O₅