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Murcko scaffold

Ring system with 4 rings and 17 atoms

13 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
17
Chemicals
13
With full pages
3
Scaffold SMILES

c1ccc2c(c1)cc1c3c(cccc32)CCN1

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 c1ccc2c(c1)cc1c3c(cccc32)CCN1

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 13 of 13 chemicals

Aporphine, 6a,7-didehydro-7-methyl-1,2,9,10-tetramethoxy-, hydrochloride chemical structure, C22H26ClNO4, CAS 74642-56-1
Aporphine, 6a,7-didehydro-7-methyl-1,2,9,10-tetramethoxy-, hydrochloride
CAS 74642-56-1C22H26ClNO4
N-Demethyl-N-formyldehydronuciferine chemical structure, C19H17NO3, CAS 111017-06-2
N-Demethyl-N-formyldehydronuciferine
CAS 111017-06-2C19H17NO3
1,2,10-Trimethoxydehydroaporphine chemical structure, C20H21NO3, CAS 70403-80-4
1,2,10-Trimethoxydehydroaporphine
CAS 70403-80-4C20H21NO3
Duguespixine chemical structure, C19H17NO3, CAS 96910-76-8
Duguespixine
CAS 96910-76-8C19H17NO3
6A,7-Dehydroboldine chemical structure, C19H19NO4, CAS 91599-23-4
6A,7-Dehydroboldine
CAS 91599-23-4C19H19NO4
Dehydropredicentrine chemical structure, C20H21NO4, CAS 91794-10-4
Dehydropredicentrine
CAS 91794-10-4C20H21NO4
Ethyl 1,2,9,10-tetramethoxy-4,5-dihydro-6H-dibenzo(de,g)quinoline-6-carboxylate chemical structure, C23H25NO6, CAS 7630-72-0
Ethyl 1,2,9,10-tetramethoxy-4,5-dihydro-6H-dibenzo(de,g)quinoline-6-carboxylate
CAS 7630-72-0C23H25NO6
Dehydroglaucine chemical structure, C21H23NO4, CAS 22212-26-6
Dehydroglaucine
CAS 22212-26-6C21H23NO4
5,6-Dihydro-1,2-dimethoxy-6-methyl-4H-dibenzo(de,g)quinoline chemical structure, C19H19NO2, CAS 7630-74-2
5,6-Dihydro-1,2-dimethoxy-6-methyl-4H-dibenzo(de,g)quinoline
CAS 7630-74-2C19H19NO2
Dehydrolirinidine chemical structure, C18H17NO2, CAS 218629-67-5
Dehydrolirinidine
CAS 218629-67-5C18H17NO2
3,4-Dimethoxy-10-methyl-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,8,13(17),14-heptaene chemical structure, C19H19NO2, CAS 18605-43-1
3,4-Dimethoxy-10-methyl-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,8,13(17),14-heptaene
CAS 18605-43-1C19H19NO2
Dehydroformouregine chemical structure, C20H19NO4, CAS 107633-69-2
Dehydroformouregine
CAS 107633-69-2C20H19NO4
6-Formyl-1,2,9,10-tetramethoxy-6a,7-dehydroaporphine chemical structure, C21H21NO5, CAS 2101836-45-5
6-Formyl-1,2,9,10-tetramethoxy-6a,7-dehydroaporphine
CAS 2101836-45-5C21H21NO5