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Murcko scaffold

Ring system with 7 rings and 20 atoms

10 chemicals on CompoundList share this ring system.

Rings
7
Scaffold atoms
20
Chemicals
10
With full pages
2
Scaffold SMILES

C=C1CN2C3CC1C1CC4(CC12)C3=Nc1ccccc14

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=C1CN2C3CC1C1CC4(CC12)C3=Nc1ccccc14

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 10 of 10 chemicals

Vinorine chemical structure, C21H22N2O2, CAS 34020-07-0
Vinorine
CAS 34020-07-0C21H22N2O2
Ajmalan-17,21-diol, 1,2,19,20-tetradehydro-1-demethyl-, 17-acetate, (17R,19E,21alpha)- chemical structure, C21H22N2O3
Ajmalan-17,21-diol, 1,2,19,20-tetradehydro-1-demethyl-, 17-acetate, (17R,19E,21alpha)-
C21H22N2O3
Vomilenine chemical structure, C21H22N2O3, CAS 6880-50-8
Vomilenine
CAS 6880-50-8C21H22N2O3
[(1R,10S,12R,13E,16S,17S,18R)-13-Ethylidene-15-oxido-8-aza-15-azoniahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate chemical structure, C21H22N2O3, CAS 1188932-15-1
[(1R,10S,12R,13E,16S,17S,18R)-13-Ethylidene-15-oxido-8-aza-15-azoniahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate
CAS 1188932-15-1C21H22N2O3
[(10S,12S,13E,14R,16S,18R)-13-Ethylidene-14-hydroxy-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate chemical structure, C21H22N2O3
[(10S,12S,13E,14R,16S,18R)-13-Ethylidene-14-hydroxy-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate
C21H22N2O3
[(1R,10S,12R,13E,16S,18R)-13-Ethylidene-15-oxido-8-aza-15-azoniahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate chemical structure, C21H22N2O3
[(1R,10S,12R,13E,16S,18R)-13-Ethylidene-15-oxido-8-aza-15-azoniahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate
C21H22N2O3
[(1R,10S,13E,16S,18R)-13-Ethylidene-15-oxido-8-aza-15-azoniahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate chemical structure, C21H22N2O3
[(1R,10S,13E,16S,18R)-13-Ethylidene-15-oxido-8-aza-15-azoniahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate
C21H22N2O3
[(10S,13E,14R,16S,18R)-13-Ethylidene-14-hydroxy-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate chemical structure, C21H22N2O3
[(10S,13E,14R,16S,18R)-13-Ethylidene-14-hydroxy-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate
C21H22N2O3
[(1R,10S,12S,13E,14R,16S,18R)-13-Ethylidene-14-hydroxy-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate chemical structure, C21H22N2O3
[(1R,10S,12S,13E,14R,16S,18R)-13-Ethylidene-14-hydroxy-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate
C21H22N2O3
[(1R,10S,16S,18R)-13-Ethylidene-15-oxido-8-aza-15-azoniahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate chemical structure, C21H22N2O3
[(1R,10S,16S,18R)-13-Ethylidene-15-oxido-8-aza-15-azoniahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate
C21H22N2O3