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Murcko scaffold

Ring system with 7 rings and 32 atoms

6 chemicals on CompoundList share this ring system.

Rings
7
Scaffold atoms
32
Chemicals
6
With full pages
1
Scaffold SMILES

C1=C2CC(OC3CCCCO3)CCC2C2CCC3C4CC5(CCCCO5)OC4CC3C2C1

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 C1=C2CC(OC3CCCCO3)CCC2C2CCC3C4CC5(CCCCO5)OC4CC3C2C1

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 6 of 6 chemicals

Trillin chemical structure, C33H52O8, CAS 14144-06-0
Trillin
CAS 14144-06-0C33H52O8
Diosgenin-3-O-|A-D-sodium glucuronide chemical structure, C33H49NaO9, CAS 32471-99-1
Diosgenin-3-O-|A-D-sodium glucuronide
CAS 32471-99-1C33H49NaO9
(2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[(1S,2S,4S,5'S,6S,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.0(2).0.0(1)(3)(1)]icos-18-ene-6,2'-tetrahydropyran]-16-yl]oxy-tetrahydropyran-2-carboxylic acid chemical structure, C33H50O9, CAS 31300-88-6
(2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[(1S,2S,4S,5'S,6S,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.0(2).0.0(1)(3)(1)]icos-18-ene-6,2'-tetrahydropyran]-16-yl]oxy-tetrahydropyran-2-carboxylic acid
CAS 31300-88-6C33H50O9
3,4,5-Trihydroxy-6-[(6S,9S,13R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxyoxane-2-carboxylic acid chemical structure, C33H50O9
3,4,5-Trihydroxy-6-[(6S,9S,13R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxyoxane-2-carboxylic acid
C33H50O9
25(S)Ruscogenin 3-O-|A-L-rhamnopyranoside chemical structure, C33H52O8, CAS 1869126-66-8
25(S)Ruscogenin 3-O-|A-L-rhamnopyranoside
CAS 1869126-66-8C33H52O8
Diosgenin-3-O-beta-D-sodium glucuronide chemical structure, C33H50NaO9
Diosgenin-3-O-beta-D-sodium glucuronide
C33H50NaO9