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Murcko scaffold

Ring system with 5 rings and 24 atoms

9 chemicals on CompoundList share this ring system.

Rings: 5
Scaffold atoms: 24
Chemicals: 9
With full pages: 1

Scaffold SMILES

O=C1CC2=C3CC4CCCC(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=C1CC2=C3CC4CCCC(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 9 of 9 chemicals

Fissinolide chemical structure, C29H36O8, CAS 1915-69-1

CAS 1915-69-1C₂₉H₃₆O₈

2-Hydroxyfissinolide chemical structure, C29H36O9, CAS 29243-94-5

2-Hydroxyfissinolide

CAS 29243-94-5C₂₉H₃₆O₉

Swietmanin E chemical structure, C32H40O10, CAS 1197347-45-7

CAS 1197347-45-7C₃₂H₄₀O₁₀

Swietmanin F chemical structure, C29H36O10, CAS 1197347-47-9

CAS 1197347-47-9C₂₉H₃₆O₁₀

RefChem:353139 chemical structure, C31H38O11, CAS 1220508-32-6

CAS 1220508-32-6C₃₁H₃₈O₁₁

[(1R,2S,5R,6R,14R,16S)-6-(Furan-3-yl)-16-[(1R)-1-hydroxy-2-methoxy-2-oxoethyl]-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-10-en-14-yl] (E)-2-methylbut-2-enoate chemical structure, C32H40O9, CAS 29243-96-7

[(1R,2S,5R,6R,14R,16S)-6-(Furan-3-yl)-16-[(1R)-1-hydroxy-2-methoxy-2-oxoethyl]-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-10-en-14-yl] (E)-2-methylbut-2-enoate

CAS 29243-96-7C₃₂H₄₀O₉

Methyl (2R)-2-acetyloxy-2-[(1R,2S,5R,6R,14R,16S)-14-acetyloxy-6-(furan-3-yl)-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-10-en-16-yl]acetate chemical structure, C31H38O10, CAS 18641-94-6

Methyl (2R)-2-acetyloxy-2-[(1R,2S,5R,6R,14R,16S)-14-acetyloxy-6-(furan-3-yl)-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-10-en-16-yl]acetate

CAS 18641-94-6C₃₁H₃₈O₁₀

[(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-10-en-14-yl] (E)-2-methylbut-2-enoate chemical structure, C32H40O8, CAS 20098-86-6

[(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-10-en-14-yl] (E)-2-methylbut-2-enoate

CAS 20098-86-6C₃₂H₄₀O₈

Methyl (2R)-2-[(1R,2S,5R,6R,14R,16S)-14-acetyloxy-6-(furan-3-yl)-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-10-en-16-yl]-2-hydroxyacetate chemical structure, C29H36O9, CAS 121825-43-2

Methyl (2R)-2-[(1R,2S,5R,6R,14R,16S)-14-acetyloxy-6-(furan-3-yl)-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-10-en-16-yl]-2-hydroxyacetate

CAS 121825-43-2C₂₉H₃₆O₉