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Murcko scaffold

Ring system with 4 rings and 18 atoms

12 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
18
Chemicals
12
With full pages
5
Scaffold SMILES

O=C1C=C2CC3CCC4CCCCC4C3CC2O1

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=C1C=C2CC3CCC4CCCCC4C3CC2O1

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 12 of 12 chemicals

Sucutinirane A chemical structure, C22H32O5, CAS 1034558-62-7
Sucutinirane A
CAS 1034558-62-7C22H32O5
(-)-Caesalpinolide C chemical structure, C20H30O4, CAS 1132772-44-1
(-)-Caesalpinolide C
CAS 1132772-44-1C20H30O4
Sucutinirane B chemical structure, C22H32O4, CAS 1034558-63-8
Sucutinirane B
CAS 1034558-63-8C22H32O4
Chagreslactone chemical structure, C25H36O8, CAS 799269-22-0
Chagreslactone
CAS 799269-22-0C25H36O8
Neocaesalpin C chemical structure, C24H34O9, CAS 305365-73-5
Neocaesalpin C
CAS 305365-73-5C24H34O9
(5,6-Diacetyloxy-4a,7,10a-trihydroxy-4,4,7,11b-tetramethyl-9-oxo-1,2,3,5,6,6a,11,11a-octahydronaphtho[2,1-f][1]benzofuran-1-yl) acetate chemical structure, C26H36O11
(5,6-Diacetyloxy-4a,7,10a-trihydroxy-4,4,7,11b-tetramethyl-9-oxo-1,2,3,5,6,6a,11,11a-octahydronaphtho[2,1-f][1]benzofuran-1-yl) acetate
C26H36O11
6a,7,11-Trihydroxy-4,4,8,11b-tetramethyl-1,2,3,4a,5,6,7,10a,11,11a-decahydronaphtho[2,1-f][1]benzofuran-9-one chemical structure, C20H30O5
6a,7,11-Trihydroxy-4,4,8,11b-tetramethyl-1,2,3,4a,5,6,7,10a,11,11a-decahydronaphtho[2,1-f][1]benzofuran-9-one
C20H30O5
Yuexiandajisu E chemical structure, C20H30O5, CAS 866556-16-3
Yuexiandajisu E
CAS 866556-16-3C20H30O5
Yuexiandajisu D chemical structure, C20H30O5, CAS 866556-15-2
Yuexiandajisu D
CAS 866556-15-2C20H30O5
Neocaesalpin L chemical structure, C26H36O11, CAS 952473-86-8
Neocaesalpin L
CAS 952473-86-8C26H36O11
(4aS,6aR,7R,10aR,11S,11aS,11bS)-6a,7,11-Trihydroxy-4,4,8,11b-tetramethyl-1,2,3,4a,5,6,7,10a,11,11a-decahydronaphtho[2,1-f][1]benzofuran-9-one chemical structure, C20H30O5
(4aS,6aR,7R,10aR,11S,11aS,11bS)-6a,7,11-Trihydroxy-4,4,8,11b-tetramethyl-1,2,3,4a,5,6,7,10a,11,11a-decahydronaphtho[2,1-f][1]benzofuran-9-one
C20H30O5
Methyl 1,6-diacetyloxy-4a,10a-dihydroxy-4,4,11b-trimethyl-9-oxo-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-7-carboxylate chemical structure, C25H34O10, CAS 1309079-08-0
Methyl 1,6-diacetyloxy-4a,10a-dihydroxy-4,4,11b-trimethyl-9-oxo-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-7-carboxylate
CAS 1309079-08-0C25H34O10