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Murcko scaffold

Ring system with 4 rings and 21 atoms

22 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
21
Chemicals
22
With full pages
3
Scaffold SMILES

O=C(OC1CC2COC3(CCCCC13)C2)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(OC1CC2COC3(CCCCC13)C2)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 22 of 22 chemicals

Angulatin A chemical structure, C34H46O13, CAS 139979-81-0
Angulatin A
CAS 139979-81-0C34H46O13
Celahin C chemical structure, C28H36O10, CAS 173401-58-6
Celahin C
CAS 173401-58-6C28H36O10
Reissantin E chemical structure, C26H34O9, CAS 628290-40-4
Reissantin E
CAS 628290-40-4C26H34O9
Reissantin D chemical structure, C24H32O8, CAS 628290-39-1
Reissantin D
CAS 628290-39-1C24H32O8
Salasol A chemical structure, C28H36O10, CAS 612836-46-1
Salasol A
CAS 612836-46-1C28H36O10
Celangulin chemical structure, C32H40O14
Celangulin
C32H40O14
Celangulin IV chemical structure, C34H44O14, CAS 144409-63-2
Celangulin IV
CAS 144409-63-2C34H44O14
Celangulin III chemical structure, C34H44O14
Celangulin III
C34H44O14
Triptogelin G-2 chemical structure, C24H32O5, CAS 145940-88-1
Triptogelin G-2
CAS 145940-88-1C24H32O5
Celangulin V chemical structure, C34H46O13
Celangulin V
C34H46O13
Malkangunin chemical structure, C24H32O7, CAS 52691-06-2
Malkangunin
CAS 52691-06-2C24H32O7
Celangulin V chemical structure, C34H46O13
Celangulin V
C34H46O13
[(1S,2S,4S,5R,6S,7S,8S,9S,12R)-4,5,8-Triacetyloxy-6-(acetyloxymethyl)-2,12-dihydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] benzoate chemical structure, C30H38O13, CAS 1253119-29-7
[(1S,2S,4S,5R,6S,7S,8S,9S,12R)-4,5,8-Triacetyloxy-6-(acetyloxymethyl)-2,12-dihydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] benzoate
CAS 1253119-29-7C30H38O13
[(1S,2S,4S,5R,6S,7S,8S,9R,12R)-4,5,8,12-Tetraacetyloxy-6-(acetyloxymethyl)-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] benzoate chemical structure, C32H40O14
[(1S,2S,4S,5R,6S,7S,8S,9R,12R)-4,5,8,12-Tetraacetyloxy-6-(acetyloxymethyl)-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] benzoate
C32H40O14
Triptregelol A chemical structure, C26H34O10, CAS 2197992-86-0
Triptregelol A
CAS 2197992-86-0C26H34O10
Celangulatin C chemical structure, C32H42O13, CAS 1000784-44-0
Celangulatin C
CAS 1000784-44-0C32H42O13
Angulatin E chemical structure, C35H48O13, CAS 403613-20-7
Angulatin E
CAS 403613-20-7C35H48O13
Celangulin chemical structure, C32H40O14, CAS 116159-73-0
Celangulin
CAS 116159-73-0C32H40O14
Orb1941657 chemical structure, C34H46O13
Orb1941657
C34H46O13
[(1S,2S,4S,5R,6S,7S,8R,9R)-4,5,8,12-Tetraacetyloxy-6-(acetyloxymethyl)-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] benzoate chemical structure, C32H40O14
[(1S,2S,4S,5R,6S,7S,8R,9R)-4,5,8,12-Tetraacetyloxy-6-(acetyloxymethyl)-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] benzoate
C32H40O14
[(1S,2R,4S,5R,6S,7S,8S,9R,12R)-4,5,8,12-Tetraacetyloxy-6-(acetyloxymethyl)-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] benzoate chemical structure, C32H40O13, CAS 128443-60-7
[(1S,2R,4S,5R,6S,7S,8S,9R,12R)-4,5,8,12-Tetraacetyloxy-6-(acetyloxymethyl)-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] benzoate
CAS 128443-60-7C32H40O13
4,6,7,10-Tetrakis(acetyloxy)-9-hydroxy-2,2,9-trimethyl-5a-{[(2-methylpropanoyl)oxy]methyl}octahydro-2H-3,9a-methano-1-benzoxepin-5-yl benzoate chemical structure, C34H44O14, CAS 144379-42-0
4,6,7,10-Tetrakis(acetyloxy)-9-hydroxy-2,2,9-trimethyl-5a-{[(2-methylpropanoyl)oxy]methyl}octahydro-2H-3,9a-methano-1-benzoxepin-5-yl benzoate
CAS 144379-42-0C34H44O14