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Murcko scaffold

Ring system with 15 rings and 41 atoms

3 chemicals on CompoundList share this ring system.

Rings
15
Scaffold atoms
41
Chemicals
3
With full pages
0
Scaffold SMILES

C1=C2C3=C(CCC24CC2C1C21CCC2(CC56CCC7C8CCCC79C(NC8)C5CC2CC69)OC41)C1CNCC(C3)C1

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=C2C3=C(CCC24CC2C1C21CCC2(CC56CCC7C8CCCC79C(NC8)C5CC2CC69)OC41)C1CNCC(C3)C1

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 3 of 3 chemicals

Staphisine chemical structure, C43H60N2O2, CAS 36576-56-4
Staphisine
CAS 36576-56-4C43H60N2O2
Staphidine chemical structure, C42H58N2O, CAS 59588-15-7
Staphidine
CAS 59588-15-7C42H58N2O
(1'R,5R,5'R,8'R,9R,9'R,11'R,14'S,15R,17'R,18'R,19S,21R)-10'-Methoxy-5,5',7,7'-tetramethylspiro[20-oxa-7-azaheptacyclo[13.6.1.15,9.01,12.04,11.014,16.016,21]tricosa-4(11),12-diene-19,12'-7-azahexacyclo[9.6.2.01,8.05,17.09,14.014,18]nonadecane] chemical structure, C43H60N2O2
(1'R,5R,5'R,8'R,9R,9'R,11'R,14'S,15R,17'R,18'R,19S,21R)-10'-Methoxy-5,5',7,7'-tetramethylspiro[20-oxa-7-azaheptacyclo[13.6.1.15,9.01,12.04,11.014,16.016,21]tricosa-4(11),12-diene-19,12'-7-azahexacyclo[9.6.2.01,8.05,17.09,14.014,18]nonadecane]
C43H60N2O2