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Murcko scaffold

Ring system with 5 rings and 19 atoms

5 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
19
Chemicals
5
With full pages
1
Scaffold SMILES

O=C1CCC2C1CCC1C2CC2OC23CCCCC13

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=C1CCC2C1CCC1C2CC2OC23CCCCC13

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 5 of 5 chemicals

Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)- chemical structure, C21H30O4, CAS 68974-62-9
Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)-
CAS 68974-62-9C21H30O4
(3beta,5beta,6beta)-5,6-Epoxy-3-hydroxyandrostan-17-one chemical structure, C19H28O3, CAS 10338-34-8
(3beta,5beta,6beta)-5,6-Epoxy-3-hydroxyandrostan-17-one
CAS 10338-34-8C19H28O3
17-Oxo-5,6-epoxyandrostan-3-yl acetate chemical structure, C21H30O4, CAS 14545-93-8
17-Oxo-5,6-epoxyandrostan-3-yl acetate
CAS 14545-93-8C21H30O4
(3beta,5beta,6beta)-3-(Acetyloxy)-5,6-epoxyandrostan-17-one chemical structure, C21H30O4, CAS 6585-68-8
(3beta,5beta,6beta)-3-(Acetyloxy)-5,6-epoxyandrostan-17-one
CAS 6585-68-8C21H30O4
(3beta,5beta,6beta,7beta,15alpha)-3,15-Bis(2,2-dimethyl-1-oxopropoxy)-5,6-epoxy-7-hydroxyandrostan-17-one chemical structure, C29H44O7, CAS 1235460-56-6
(3beta,5beta,6beta,7beta,15alpha)-3,15-Bis(2,2-dimethyl-1-oxopropoxy)-5,6-epoxy-7-hydroxyandrostan-17-one
CAS 1235460-56-6C29H44O7