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Murcko scaffold

Ring system with 7 rings and 20 atoms

21 chemicals on CompoundList share this ring system.

Rings
7
Scaffold atoms
20
Chemicals
21
With full pages
6
Scaffold SMILES

C=C1CC23CCC1CC2C12CCCC4CNC1C3CC42

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 C=C1CC23CCC1CC2C12CCCC4CNC1C3CC42

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

Denudatine chemical structure, C22H33NO2
Denudatine
C22H33NO2
Lepetine chemical structure, C24H35NO4
Lepetine
C24H35NO4
Lepedine chemical structure, C23H35NO3, CAS 111509-09-2
Lepedine
CAS 111509-09-2C23H35NO3
Lepenine chemical structure, C22H33NO3, CAS 111524-32-4
Lepenine
CAS 111524-32-4C22H33NO3
Denudatine chemical structure, C22H33NO2
Denudatine
C22H33NO2
7-Ethyl-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol chemical structure, C22H33NO2
7-Ethyl-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol
C22H33NO2
Denudatine chemical structure, C22H33NO2, CAS 26166-37-0
Denudatine
CAS 26166-37-0C22H33NO2
[(2S,8R,9S,11R,13S,14S,15R,16S)-7-Ethyl-2,11-dihydroxy-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecan-14-yl] acetate chemical structure, C24H35NO4, CAS 111509-08-1
[(2S,8R,9S,11R,13S,14S,15R,16S)-7-Ethyl-2,11-dihydroxy-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecan-14-yl] acetate
CAS 111509-08-1C24H35NO4
(7-Ethyl-2,11-dihydroxy-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecan-14-yl) acetate chemical structure, C24H35NO4
(7-Ethyl-2,11-dihydroxy-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecan-14-yl) acetate
C24H35NO4
Bullatine A chemical structure, C22H33NO2, CAS 1354-84-3
Bullatine A
CAS 1354-84-3C22H33NO2
Denudatine chemical structure, C22H33NO2
Denudatine
C22H33NO2
(8R,9R,10S,11R,13R,14S,15S,16S)-7-Ethyl-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol chemical structure, C22H33NO2
(8R,9R,10S,11R,13R,14S,15S,16S)-7-Ethyl-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol
C22H33NO2
(1S,5R,10S)-7-Ethyl-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol chemical structure, C22H33NO2
(1S,5R,10S)-7-Ethyl-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol
C22H33NO2
(1S,5R,8R)-7-Ethyl-5-methyl-12-methylene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol chemical structure, C22H33NO2
(1S,5R,8R)-7-Ethyl-5-methyl-12-methylene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol
C22H33NO2
Lepetine chemical structure, C24H35NO4
Lepetine
C24H35NO4
Lepenine N-oxide chemical structure, C22H33NO4, CAS 169134-44-5
Lepenine N-oxide
CAS 169134-44-5C22H33NO4
8,10a-Ethano-11,3,6a-ethanylylidene-8H-indeno[2,1-b]azocine-7,10-diol, 1-ethyldodecahydro-3-methyl-9-methylene-, (3R,6aS,6bS,7S,8R,10R,10aS,11R,11aR,13R)- chemical structure, C22H33NO2
8,10a-Ethano-11,3,6a-ethanylylidene-8H-indeno[2,1-b]azocine-7,10-diol, 1-ethyldodecahydro-3-methyl-9-methylene-, (3R,6aS,6bS,7S,8R,10R,10aS,11R,11aR,13R)-
C22H33NO2
(1R,5S,9S,10R,11R,13R,14S,15S,16R)-7-Ethyl-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol chemical structure, C22H33NO2
(1R,5S,9S,10R,11R,13R,14S,15S,16R)-7-Ethyl-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol
C22H33NO2
[(2S,5R,8R,9R,10S,11R,13R,14S,15R,16R)-7-Ethyl-2,11-dihydroxy-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecan-14-yl] acetate chemical structure, C24H35NO4
[(2S,5R,8R,9R,10S,11R,13R,14S,15R,16R)-7-Ethyl-2,11-dihydroxy-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecan-14-yl] acetate
C24H35NO4
(1S,5R,8R,14S,15S,16R)-7-Ethyl-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol chemical structure, C22H33NO2
(1S,5R,8R,14S,15S,16R)-7-Ethyl-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol
C22H33NO2
(1S,14S,15S,16R)-7-Ethyl-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol chemical structure, C22H33NO2
(1S,14S,15S,16R)-7-Ethyl-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol
C22H33NO2