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Murcko scaffold

Hexahydroindolinone scaffold

21 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
10
Chemicals
21
With full pages
6
Scaffold SMILES

O=C1CC2CCCCC2N1

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 scaffoldOpen the Hexahydroindolinone page
Murcko scaffold O=C1CC2CCCCC2N1

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 21 of 21 chemicals

rel-(3aR,7aR)-Octahydro-2H-indol-2-one chemical structure, C8H13NO, CAS 1195-13-7
rel-(3aR,7aR)-Octahydro-2H-indol-2-one
CAS 1195-13-7C8H13NO
Hexahydroindolinone chemical structure, C8H13NO, CAS 90154-87-3
Hexahydroindolinone
CAS 90154-87-3C8H13NO
Octahydro-2-oxo-1H-Indole-7-acetic acid chemical structure, C10H15NO3, CAS 99323-62-3
Octahydro-2-oxo-1H-Indole-7-acetic acid
CAS 99323-62-3C10H15NO3
rel-(3aR,7aR)-Octahydro-2-oxo-7aH-indole-7a-carbonitrile chemical structure, C9H12N2O, CAS 205688-53-5
rel-(3aR,7aR)-Octahydro-2-oxo-7aH-indole-7a-carbonitrile
CAS 205688-53-5C9H12N2O
2-Oxo-octahydro-1H-indole-6-carboxylic acid chemical structure, C9H13NO3, CAS 2167493-95-8
2-Oxo-octahydro-1H-indole-6-carboxylic acid
CAS 2167493-95-8C9H13NO3
rac-(3aR,7aS)-3a-amino-octahydro-1H-indol-2-one chemical structure, C8H14N2O, CAS 2137836-49-6
rac-(3aR,7aS)-3a-amino-octahydro-1H-indol-2-one
CAS 2137836-49-6C8H14N2O
rac-(3aR,7aS)-2-oxo-octahydro-1H-indole-3a-carboxylic acid chemical structure, C9H13NO3, CAS 2307754-61-4
rac-(3aR,7aS)-2-oxo-octahydro-1H-indole-3a-carboxylic acid
CAS 2307754-61-4C9H13NO3
Sodium 2-oxo-octahydro-1H-indole-6-carboxylate chemical structure, C9H12NNaO3, CAS 2172018-86-7
Sodium 2-oxo-octahydro-1H-indole-6-carboxylate
CAS 2172018-86-7C9H12NNaO3
Ethyl 2-oxo-octahydro-1H-indole-3a-carboxylate chemical structure, C11H17NO3, CAS 1824604-23-0
Ethyl 2-oxo-octahydro-1H-indole-3a-carboxylate
CAS 1824604-23-0C11H17NO3
rac-Ethyl (3aR,7aS)-2-oxo-octahydro-1H-indole-3a-carboxylate chemical structure, C11H17NO3, CAS 57475-26-0
rac-Ethyl (3aR,7aS)-2-oxo-octahydro-1H-indole-3a-carboxylate
CAS 57475-26-0C11H17NO3
3,3-Dimethyl-2-oxo-octahydro-1H-indole-5-carboxylic acid chemical structure, C11H17NO3, CAS 2253629-42-2
3,3-Dimethyl-2-oxo-octahydro-1H-indole-5-carboxylic acid
CAS 2253629-42-2C11H17NO3
rac-N-[(3aR,7aS)-2-oxo-octahydro-1H-indol-3a-yl]-2-chloroacetamide chemical structure, C10H15ClN2O2, CAS 2411179-74-1
rac-N-[(3aR,7aS)-2-oxo-octahydro-1H-indol-3a-yl]-2-chloroacetamide
CAS 2411179-74-1C10H15ClN2O2
rac-(3aR,7aR)-7a-(aminomethyl)-octahydro-1H-indol-2-one, trifluoroacetic acid chemical structure, C11H17F3N2O3, CAS 2567490-02-0
rac-(3aR,7aR)-7a-(aminomethyl)-octahydro-1H-indol-2-one, trifluoroacetic acid
CAS 2567490-02-0C11H17F3N2O3
rac-(3aR,7aR)-7a-(aminomethyl)-octahydro-1H-indol-2-one chemical structure, C9H16N2O, CAS 2567489-73-8
rac-(3aR,7aR)-7a-(aminomethyl)-octahydro-1H-indol-2-one
CAS 2567489-73-8C9H16N2O
tert-Butyl N-[rel-(3AS,5S,7AS)-2-oxo-1,3,3A,4,5,6,7,7A-octahydroindol-5-yl]carbamate chemical structure, C13H22N2O3, CAS 2567864-19-9
tert-Butyl N-[rel-(3AS,5S,7AS)-2-oxo-1,3,3A,4,5,6,7,7A-octahydroindol-5-yl]carbamate
CAS 2567864-19-9C13H22N2O3
tert-Butyl N-[rel-(3AS,5R,7AS)-2-oxo-1,3,3A,4,5,6,7,7A-octahydroindol-5-yl]carbamate chemical structure, C13H22N2O3, CAS 2567864-18-8
tert-Butyl N-[rel-(3AS,5R,7AS)-2-oxo-1,3,3A,4,5,6,7,7A-octahydroindol-5-yl]carbamate
CAS 2567864-18-8C13H22N2O3
Rel-(3AS,5S,7AS)-5-hydroxy-1,3,3A,4,5,6,7,7A-octahydroindol-2-one chemical structure, C8H13NO2, CAS 2567864-13-3
Rel-(3AS,5S,7AS)-5-hydroxy-1,3,3A,4,5,6,7,7A-octahydroindol-2-one
CAS 2567864-13-3C8H13NO2
Rel-(3AS,5R,7AS)-5-hydroxy-1,3,3A,4,5,6,7,7A-octahydroindol-2-one chemical structure, C8H13NO2, CAS 2567864-12-2
Rel-(3AS,5R,7AS)-5-hydroxy-1,3,3A,4,5,6,7,7A-octahydroindol-2-one
CAS 2567864-12-2C8H13NO2
Methyl rel-(3AS,5S,7AS)-2-oxo-1,3,3A,4,5,6,7,7A-octahydroindole-5-carboxylate chemical structure, C10H15NO3, CAS 2567864-10-0
Methyl rel-(3AS,5S,7AS)-2-oxo-1,3,3A,4,5,6,7,7A-octahydroindole-5-carboxylate
CAS 2567864-10-0C10H15NO3
Methyl rel-(3AS,5R,7AS)-2-oxo-1,3,3A,4,5,6,7,7A-octahydroindole-5-carboxylate chemical structure, C10H15NO3, CAS 2567864-09-7
Methyl rel-(3AS,5R,7AS)-2-oxo-1,3,3A,4,5,6,7,7A-octahydroindole-5-carboxylate
CAS 2567864-09-7C10H15NO3
3a-Amino-octahydro-1H-indol-2-one chemical structure, C8H14N2O, CAS 2137588-57-7
3a-Amino-octahydro-1H-indol-2-one
CAS 2137588-57-7C8H14N2O