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Murcko scaffold

Ring system with 5 rings and 24 atoms

8 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
24
Chemicals
8
With full pages
3
Scaffold SMILES

O=C1CC2C3=CC4CCCC(C4=O)C3CCC2C(c2ccoc2)O1

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=C1CC2C3=CC4CCCC(C4=O)C3CCC2C(c2ccoc2)O1

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 8 of 8 chemicals

Methyl 3-isobutyryloxy-1-oxomeliac-8(30)-enate chemical structure, C31H40O8, CAS 28057-72-9
Methyl 3-isobutyryloxy-1-oxomeliac-8(30)-enate
CAS 28057-72-9C31H40O8
Swietenine chemical structure, C32H40O9, CAS 4801-97-2
Swietenine
CAS 4801-97-2C32H40O9
11alpha-Acetoxy-2alpha-hydroxy-6-deoxydestigloylswietenine acetate chemical structure, C31H38O11, CAS 1189801-55-5
11alpha-Acetoxy-2alpha-hydroxy-6-deoxydestigloylswietenine acetate
CAS 1189801-55-5C31H38O11
Swietmanin A chemical structure, C33H42O10, CAS 1197347-38-8
Swietmanin A
CAS 1197347-38-8C33H42O10
Swietmanin B chemical structure, C31H38O10, CAS 1197347-40-2
Swietmanin B
CAS 1197347-40-2C31H38O10
Swietmanin C chemical structure, C29H36O9, CAS 1197347-42-4
Swietmanin C
CAS 1197347-42-4C29H36O9
[(1R,2S,5R,6R,14R,16S)-16-[(1R)-1-Acetyloxy-2-methoxy-2-oxoethyl]-6-(furan-3-yl)-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-11-en-14-yl] (E)-2-methylbut-2-enoate chemical structure, C34H42O10, CAS 89913-62-2
[(1R,2S,5R,6R,14R,16S)-16-[(1R)-1-Acetyloxy-2-methoxy-2-oxoethyl]-6-(furan-3-yl)-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-11-en-14-yl] (E)-2-methylbut-2-enoate
CAS 89913-62-2C34H42O10
[(1R,2S,5R,6R,14R,16S)-6-(Furan-3-yl)-16-(2-methoxy-2-oxoethyl)-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-11-en-14-yl] (E)-2-methylbut-2-enoate chemical structure, C32H40O8, CAS 70022-91-2
[(1R,2S,5R,6R,14R,16S)-6-(Furan-3-yl)-16-(2-methoxy-2-oxoethyl)-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-11-en-14-yl] (E)-2-methylbut-2-enoate
CAS 70022-91-2C32H40O8