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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
1
Scaffold SMILES

O=C1OC(=O)C2=C1CCCC1=C(CC2)C(=O)OC1=O

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=C1OC(=O)C2=C1CCCC1=C(CC2)C(=O)OC1=O

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

(4S,10R)-10-Ethyl-5,9,10,11-tetrahydro-4-propyl-1H-cyclonona(1,2-c:5,6-c')difuran-1,3,6,8(4H)-tetrone chemical structure, C18H20O6, CAS 743-51-1
(4S,10R)-10-Ethyl-5,9,10,11-tetrahydro-4-propyl-1H-cyclonona(1,2-c:5,6-c')difuran-1,3,6,8(4H)-tetrone
CAS 743-51-1C18H20O6
10-Butyl-10-hydroxy-2-pentyl-6,14-dioxatricyclo[10.3.0.04,8]pentadeca-1(12),4(8)-diene-5,7,13,15-tetrone chemical structure, C22H28O7, CAS 907202-96-4
10-Butyl-10-hydroxy-2-pentyl-6,14-dioxatricyclo[10.3.0.04,8]pentadeca-1(12),4(8)-diene-5,7,13,15-tetrone
CAS 907202-96-4C22H28O7
Castaneiolide chemical structure, C22H28O8, CAS 125300-50-7
Castaneiolide
CAS 125300-50-7C22H28O8
Heveadride chemical structure, C18H20O6, CAS 39595-41-0
Heveadride
CAS 39595-41-0C18H20O6
Scytalidic acid chemical structure, C22H28O7, CAS 39012-16-3
Scytalidic acid
CAS 39012-16-3C22H28O7