CompoundList
Sign in
Murcko scaffold

Cyclohexadienone scaffold

138 chemicals on CompoundList share this ring system.

Rings
1
Scaffold atoms
7
Chemicals
138
With full pages
11
Scaffold SMILES

O=C1C=CC=CC1

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. This is a very common single ring, so the list below is broad.

Substructure search with this scaffoldOpen the Cyclohexadienone page
Murcko scaffold O=C1C=CC=CC1

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 48 of 138 chemicals

Lupulone chemical structure, C26H38O4, CAS 468-28-0
Lupulone
CAS 468-28-0C26H38O4
(6S)-3,5,6-Trihydroxy-4,6-bis(3-methyl-2-buten-1-yl)-2-(3-methyl-1-oxobutyl)-2,4-cyclohexadien-1-one chemical structure, C21H30O5, CAS 1263285-59-1
(6S)-3,5,6-Trihydroxy-4,6-bis(3-methyl-2-buten-1-yl)-2-(3-methyl-1-oxobutyl)-2,4-cyclohexadien-1-one
CAS 1263285-59-1C21H30O5
2,6,6-Trimethyl-2,4-cyclohexadien-1-one chemical structure, C9H12O, CAS 13487-30-4
2,6,6-Trimethyl-2,4-cyclohexadien-1-one
CAS 13487-30-4C9H12O
(R)-3,5,6-Trihydroxy-4,6-bis(3-methylbut-2-enyl)-2-(3-methyl-2-oxobutyl)cyclohexa-2,4-dien-1-one, lead salt chemical structure, C21H28O5Pb, CAS 68901-11-1
(R)-3,5,6-Trihydroxy-4,6-bis(3-methylbut-2-enyl)-2-(3-methyl-2-oxobutyl)cyclohexa-2,4-dien-1-one, lead salt
CAS 68901-11-1C21H28O5Pb
Cyclohexadienone chemical structure, C6H6O, CAS 24599-57-3
Cyclohexadienone
CAS 24599-57-3C6H6O
2,3,4,5,6,6-Hexachloro-2,4-cyclohexadienone chemical structure, C6Cl6O, CAS 21306-21-8
2,3,4,5,6,6-Hexachloro-2,4-cyclohexadienone
CAS 21306-21-8C6Cl6O
2,4-Cyclohexadien-1-one, 3,5,6-trihydroxy-4,6-dimethyl-2-(1-oxobutyl)- chemical structure, C12H16O5, CAS 79740-10-6
2,4-Cyclohexadien-1-one, 3,5,6-trihydroxy-4,6-dimethyl-2-(1-oxobutyl)-
CAS 79740-10-6C12H16O5
3,5,6-Trihydroxy-2-(2-methylbutanoyl)-4,6-bis(3-methylbut-2-en-1-yl)cyclohexa-2,4-dien-1-one chemical structure, C21H30O5, CAS 31769-65-0
3,5,6-Trihydroxy-2-(2-methylbutanoyl)-4,6-bis(3-methylbut-2-en-1-yl)cyclohexa-2,4-dien-1-one
CAS 31769-65-0C21H30O5
Cohumulone chemical structure, C20H28O5, CAS 511-25-1
Cohumulone
CAS 511-25-1C20H28O5
6-Hydroxy-5-methoxy-6-(2-oxopropyl)cyclohexa-2,4-dien-1-one chemical structure, C10H12O4, CAS 91061-90-4
6-Hydroxy-5-methoxy-6-(2-oxopropyl)cyclohexa-2,4-dien-1-one
CAS 91061-90-4C10H12O4
3,5-Di-tert-butyl-6-hydroxy-6-(2-oxopropyl)cyclohexa-2,4-dien-1-one chemical structure, C17H26O3, CAS 93542-32-6
3,5-Di-tert-butyl-6-hydroxy-6-(2-oxopropyl)cyclohexa-2,4-dien-1-one
CAS 93542-32-6C17H26O3
1,2,4-Trimethyl-6-oxocyclohexa-2,4-dien-1-yl acetate chemical structure, C11H14O3, CAS 20794-17-6
1,2,4-Trimethyl-6-oxocyclohexa-2,4-dien-1-yl acetate
CAS 20794-17-6C11H14O3
6-(Dichloromethyl)-2,6-dimethylcyclohexa-2,4-dien-1-one chemical structure, C9H10Cl2O, CAS 14789-76-5
6-(Dichloromethyl)-2,6-dimethylcyclohexa-2,4-dien-1-one
CAS 14789-76-5C9H10Cl2O
6-(Dichloromethyl)-5,6-dimethylcyclohexa-2,4-dien-1-one chemical structure, C9H10Cl2O, CAS 14789-79-8
6-(Dichloromethyl)-5,6-dimethylcyclohexa-2,4-dien-1-one
CAS 14789-79-8C9H10Cl2O
3,6,6-Trimethylcyclohexa-2,4-dien-1-one chemical structure, C9H12O, CAS 23438-76-8
3,6,6-Trimethylcyclohexa-2,4-dien-1-one
CAS 23438-76-8C9H12O
6-(Dichloromethyl)-3,6-dimethylcyclohexa-2,4-dien-1-one chemical structure, C9H10Cl2O, CAS 14789-77-6
6-(Dichloromethyl)-3,6-dimethylcyclohexa-2,4-dien-1-one
CAS 14789-77-6C9H10Cl2O
6-(Dichloromethyl)-6-methylcyclohexa-2,4-dien-1-one chemical structure, C8H8Cl2O, CAS 14789-75-4
6-(Dichloromethyl)-6-methylcyclohexa-2,4-dien-1-one
CAS 14789-75-4C8H8Cl2O
6-Hydroxy-3,4-dimethoxy-6-(3-methyl-3-buten-1-ynyl)-2,4-cyclohexadien-1-one chemical structure, C13H14O4, CAS 82511-11-3
6-Hydroxy-3,4-dimethoxy-6-(3-methyl-3-buten-1-ynyl)-2,4-cyclohexadien-1-one
CAS 82511-11-3C13H14O4
Colupulone chemical structure, C25H36O4, CAS 468-27-9
Colupulone
CAS 468-27-9C25H36O4
Cyclohexadienone, hydroxy- chemical structure, C6H6O2, CAS 60766-01-0
Cyclohexadienone, hydroxy-
CAS 60766-01-0C6H6O2
Humulone chemical structure, C21H30O5, CAS 26472-41-3
Humulone
CAS 26472-41-3C21H30O5
3,5,6-Trihydroxy-4,6-bis(3-methyl-2-buten-1-yl)-2-(3-methyl-1-oxobutyl)-2,4-cyclohexadien-1-one chemical structure, C21H30O5, CAS 125137-35-1
3,5,6-Trihydroxy-4,6-bis(3-methyl-2-buten-1-yl)-2-(3-methyl-1-oxobutyl)-2,4-cyclohexadien-1-one
CAS 125137-35-1C21H30O5
Npc68298 chemical structure, C8H10O3, CAS 2065-00-1
Npc68298
CAS 2065-00-1C8H10O3
3,5-Ditert-butyl-4-hydroxycyclohexa-2,4-dien-1-one chemical structure, C14H22O2, CAS 54965-43-4
3,5-Ditert-butyl-4-hydroxycyclohexa-2,4-dien-1-one
CAS 54965-43-4C14H22O2