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Murcko scaffold

Ring system with 6 rings and 34 atoms

5 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
34
Chemicals
5
With full pages
1
Scaffold SMILES

O=C1c2ccccc2C(=O)c2cc3c(cc21)C(OC1CCCCO1)CCC3OC1CCCCO1

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=C1c2ccccc2C(=O)c2cc3c(cc21)C(OC1CCCCO1)CCC3OC1CCCCO1

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

Yellamycin B chemical structure, C36H48N2O11, CAS 119445-99-7
Yellamycin B
CAS 119445-99-7C36H48N2O11
Rhodomycin A chemical structure, C36H48N2O12, CAS 23666-50-4
Rhodomycin A
CAS 23666-50-4C36H48N2O12
(7S,9R,10R)-7,10-Bis[[(2S,4S,5S,6S)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy]-9-ethyl-1,4,6,9,11-pentahydroxy-8,10-dihydro-7H-tetracene-5,12-dione chemical structure, C36H48N2O13, CAS 1403-81-2
(7S,9R,10R)-7,10-Bis[[(2S,4S,5S,6S)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy]-9-ethyl-1,4,6,9,11-pentahydroxy-8,10-dihydro-7H-tetracene-5,12-dione
CAS 1403-81-2C36H48N2O13
Rhodomycin A dihydrochloride chemical structure, C36H50Cl2N2O12, CAS 1404-51-9
Rhodomycin A dihydrochloride
CAS 1404-51-9C36H50Cl2N2O12
Alldimycin B chemical structure, C36H48N2O12, CAS 97605-82-8
Alldimycin B
CAS 97605-82-8C36H48N2O12