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Murcko scaffold

Ring system with 7 rings and 30 atoms

4 chemicals on CompoundList share this ring system.

Rings
7
Scaffold atoms
30
Chemicals
4
With full pages
1
Scaffold SMILES

O=C1CC2OCC3CC(=O)C4C(CCC5C(c6ccoc6)OC(=O)C6OC654)C32CO1

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=C1CC2OCC3CC(=O)C4C(CCC5C(c6ccoc6)OC(=O)C6OC654)C32CO1

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 4 of 4 chemicals

(1R,2R,7S,10R,13R,14R,16S,19S,20S)-19-(Furan-3-yl)-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosane-5,12,17-trione, (4R)-1-methyl-4-prop-1-en-2-ylcyclohexene chemical structure, C36H46O8, CAS 54577-49-0
(1R,2R,7S,10R,13R,14R,16S,19S,20S)-19-(Furan-3-yl)-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosane-5,12,17-trione, (4R)-1-methyl-4-prop-1-en-2-ylcyclohexene
CAS 54577-49-0C36H46O8
Limonin chemical structure, C26H30O8, CAS 1180-71-8
Limonin
CAS 1180-71-8C26H30O8
Glaucin B chemical structure, C28H32O10, CAS 115458-73-6
Glaucin B
CAS 115458-73-6C28H32O10
Orb3178088 chemical structure, C28H32O10, CAS 115458-72-5
Orb3178088
CAS 115458-72-5C28H32O10