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Murcko scaffold

Ring system with 6 rings and 25 atoms

5 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
25
Chemicals
5
With full pages
1
Scaffold SMILES

O=C1OC2CC1CC1C3=CCC4C5CCCCC5CCC4C3CCC21

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=C1OC2CC1CC1C3=CCC4C5CCCCC5CCC4C3CCC21

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

Wilforlide A chemical structure, C30H46O3, CAS 84104-71-2
Wilforlide A
CAS 84104-71-2C30H46O3
Desoxoglabrolide chemical structure, C30H46O3, CAS 10379-62-1
Desoxoglabrolide
CAS 10379-62-1C30H46O3
Wilforlide A acetate chemical structure, C32H48O4, CAS 84104-80-3
Wilforlide A acetate
CAS 84104-80-3C32H48O4
[(1R,2S,5R,6S,9S,11R,14S,15S,19R,21R)-2,5,6,10,10,14,21-Heptamethyl-22-oxo-23-oxahexacyclo[19.2.1.02,19.05,18.06,15.09,14]tetracos-17-en-11-yl] acetate chemical structure, C32H48O4
[(1R,2S,5R,6S,9S,11R,14S,15S,19R,21R)-2,5,6,10,10,14,21-Heptamethyl-22-oxo-23-oxahexacyclo[19.2.1.02,19.05,18.06,15.09,14]tetracos-17-en-11-yl] acetate
C32H48O4
(2,5,6,10,10,14,21-Heptamethyl-22-oxo-23-oxahexacyclo[19.2.1.02,19.05,18.06,15.09,14]tetracos-17-en-11-yl) acetate chemical structure, C32H48O4
(2,5,6,10,10,14,21-Heptamethyl-22-oxo-23-oxahexacyclo[19.2.1.02,19.05,18.06,15.09,14]tetracos-17-en-11-yl) acetate
C32H48O4