CompoundList
Sign in
Murcko scaffold

Ring system with 5 rings and 26 atoms

8 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
26
Chemicals
8
With full pages
1
Scaffold SMILES

O=C1C=CCC(CC2CCC3C2CCC2C4C(=O)C=CCC4=CCC23)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=C1C=CCC(CC2CCC3C2CCC2C4C(=O)C=CCC4=CCC23)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

14,20-Dihydroxy-22,26-epoxyergosta-2,5,24-triene-1,26-dione chemical structure, C28H38O5, CAS 50657-10-8
14,20-Dihydroxy-22,26-epoxyergosta-2,5,24-triene-1,26-dione
CAS 50657-10-8C28H38O5
2-[1-(4,7-Dihydroxy-10,13-dimethyl-1-oxo-4,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl)-1-hydroxyethyl]-4,5-dimethyl-2,3-dihydropyran-6-one chemical structure, C28H38O6, CAS 30655-42-6
2-[1-(4,7-Dihydroxy-10,13-dimethyl-1-oxo-4,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl)-1-hydroxyethyl]-4,5-dimethyl-2,3-dihydropyran-6-one
CAS 30655-42-6C28H38O6
20beta-Hydroxy-1-oxo-(22R)-witha-2,5,24-trienolide chemical structure, C28H38O4, CAS 79684-01-8
20beta-Hydroxy-1-oxo-(22R)-witha-2,5,24-trienolide
CAS 79684-01-8C28H38O4
Physapruin A chemical structure, C28H38O7, CAS 155178-03-3
Physapruin A
CAS 155178-03-3C28H38O7
Coagulanolide chemical structure, C28H38O7, CAS 929622-96-8
Coagulanolide
CAS 929622-96-8C28H38O7
Daturataturin A aglycone chemical structure, C28H38O5, CAS 904665-71-0
Daturataturin A aglycone
CAS 904665-71-0C28H38O5
(22R)-27-Hydroxy-1-oxowitha-2,5,24-trienolide chemical structure, C28H38O4, CAS 81874-44-4
(22R)-27-Hydroxy-1-oxowitha-2,5,24-trienolide
CAS 81874-44-4C28H38O4
2-[(1S)-1-[(10R,13S,14R,17R)-14,17-Dihydroxy-10,13-dimethyl-1-oxo-4,7,8,9,11,12,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-1-hydroxyethyl]-4,5-dimethyl-2,3-dihydropyran-6-one chemical structure, C28H38O6, CAS 50657-12-0
2-[(1S)-1-[(10R,13S,14R,17R)-14,17-Dihydroxy-10,13-dimethyl-1-oxo-4,7,8,9,11,12,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-1-hydroxyethyl]-4,5-dimethyl-2,3-dihydropyran-6-one
CAS 50657-12-0C28H38O6