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Murcko scaffold

Ring system with 3 rings and 19 atoms

5 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
19
Chemicals
5
With full pages
2
Scaffold SMILES

O=C1CCC2C1CCC(=O)C2CCc1ccccc1

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 O=C1CCC2C1CCC(=O)C2CCc1ccccc1

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 5 of 5 chemicals

3,12-Dihydroxy-9(10)-secoandrosta-1,3,5(10)-triene-9,17-dione chemical structure, C19H24O4, CAS 79683-94-6
3,12-Dihydroxy-9(10)-secoandrosta-1,3,5(10)-triene-9,17-dione
CAS 79683-94-6C19H24O4
3,4,7,12-Tetrahydroxy-9,10-seco-1,3,5(10)-androstatriene-9,17-dione chemical structure, C19H24O6, CAS 113565-94-9
3,4,7,12-Tetrahydroxy-9,10-seco-1,3,5(10)-androstatriene-9,17-dione
CAS 113565-94-9C19H24O6
4-[2-(5-Hydroxy-2-methylphenyl)ethyl]-7a-methyl-2,3,3a,4,6,7-hexahydroindene-1,5-dione chemical structure, C19H24O3, CAS 24101-21-1
4-[2-(5-Hydroxy-2-methylphenyl)ethyl]-7a-methyl-2,3,3a,4,6,7-hexahydroindene-1,5-dione
CAS 24101-21-1C19H24O3
3,4-Dihydroxy-9,10-secoandrosta-1(10),2,4-triene-9,17-dione chemical structure, C19H24O4, CAS 2168-61-8
3,4-Dihydroxy-9,10-secoandrosta-1(10),2,4-triene-9,17-dione
CAS 2168-61-8C19H24O4
3-Hydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione chemical structure, C19H24O3, CAS 2394-69-6
3-Hydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione
CAS 2394-69-6C19H24O3