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Murcko scaffold

Ring system with 5 rings and 23 atoms

7 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
23
Chemicals
7
With full pages
1
Scaffold SMILES

C=C1OCOC12CCC1C3CCC4=CC(=O)CCC4C3CCC12

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 C=C1OCOC12CCC1C3CCC4=CC(=O)CCC4C3CCC12

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 7 of 7 chemicals

YK-11 (Mixture of diasteromers) chemical structure, C25H34O6
YK-11 (Mixture of diasteromers)
C25H34O6
Orb507420 chemical structure, C25H34O6
Orb507420
C25H34O6
YK-11 chemical structure, C25H34O6, CAS 1370003-76-1
YK-11
CAS 1370003-76-1C25H34O6
YK-11 (Mixture of diasteromers) chemical structure, C25H34O6
YK-11 (Mixture of diasteromers)
C25H34O6
Methyl 2-(2'-methoxy-2',13-dimethyl-3-oxospiro[1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,5'-1,3-dioxolane]-4'-ylidene)acetate chemical structure, C25H34O6, CAS 431579-34-9
Methyl 2-(2'-methoxy-2',13-dimethyl-3-oxospiro[1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,5'-1,3-dioxolane]-4'-ylidene)acetate
CAS 431579-34-9C25H34O6
Methyl 2-[(8R,9S,13S,14S,17S)-2'-methoxy-2',13-dimethyl-3-oxospiro[1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,5'-1,3-dioxolane]-4'-ylidene]acetate chemical structure, C25H34O6
Methyl 2-[(8R,9S,13S,14S,17S)-2'-methoxy-2',13-dimethyl-3-oxospiro[1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,5'-1,3-dioxolane]-4'-ylidene]acetate
C25H34O6
Methyl 2-[(13S,17S)-2'-methoxy-2',13-dimethyl-3-oxospiro[1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,5'-1,3-dioxolane]-4'-ylidene]acetate chemical structure, C25H34O6
Methyl 2-[(13S,17S)-2'-methoxy-2',13-dimethyl-3-oxospiro[1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,5'-1,3-dioxolane]-4'-ylidene]acetate
C25H34O6