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Murcko scaffold

Ring system with 5 rings and 26 atoms

7 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
26
Chemicals
7
With full pages
1
Scaffold SMILES

O=C(OC1CCC2C(=CC=C3C4CCCC4CCC32)C1)c1ccccc1

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=C(OC1CCC2C(=CC=C3C4CCCC4CCC32)C1)c1ccccc1

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 7 of 7 chemicals

7-Dehydrocholesterol benzoate chemical structure, C34H48O2, CAS 1182-06-5
7-Dehydrocholesterol benzoate
CAS 1182-06-5C34H48O2
[(3R,9S,10R,13R,14R,17R)-10,13-Dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] benzoate chemical structure, C34H48O2, CAS 6287-68-9
[(3R,9S,10R,13R,14R,17R)-10,13-Dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] benzoate
CAS 6287-68-9C34H48O2
Cholesta-5,7-dien-3beta-ol, 3,5-dinitrobenzoate chemical structure, C34H46N2O6, CAS 5895-91-0
Cholesta-5,7-dien-3beta-ol, 3,5-dinitrobenzoate
CAS 5895-91-0C34H46N2O6
Ergosterol, 3,5-dinitrobenzoate chemical structure, C35H46N2O6, CAS 4712-10-1
Ergosterol, 3,5-dinitrobenzoate
CAS 4712-10-1C35H46N2O6
(20S)-4,4,20-Trimethyl-pregna-5,7-dien-3beta,21-diol 3-benzoate chemical structure, C31H42O3, CAS 592536-32-8
(20S)-4,4,20-Trimethyl-pregna-5,7-dien-3beta,21-diol 3-benzoate
CAS 592536-32-8C31H42O3
Pyrocalciferol 3,5-dinitrobenzoate chemical structure, C35H46N2O6, CAS 56613-84-4
Pyrocalciferol 3,5-dinitrobenzoate
CAS 56613-84-4C35H46N2O6
9EC,10I<<-ergosta-5,7,22-trien-3EC-ol, 3,5-dinitrobenzoate chemical structure, C35H46N2O6, CAS 6113-02-6
9EC,10I<<-ergosta-5,7,22-trien-3EC-ol, 3,5-dinitrobenzoate
CAS 6113-02-6C35H46N2O6