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Murcko scaffold

Ring system with 4 rings and 20 atoms

16 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
20
Chemicals
16
With full pages
4
Scaffold SMILES

C=C1C(=O)C23CC1CCC2C1(CCCCC1)COC3=O

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 C=C1C(=O)C23CC1CCC2C1(CCCCC1)COC3=O

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 16 of 16 chemicals

Isodonoic acid chemical structure, C22H28O8, CAS 84294-78-0
Isodonoic acid
CAS 84294-78-0C22H28O8
Loxothyrin A chemical structure, C24H30O9, CAS 162762-96-1
Loxothyrin A
CAS 162762-96-1C24H30O9
Lushanrubescensin H chemical structure, C22H30O6, CAS 476640-22-9
Lushanrubescensin H
CAS 476640-22-9C22H30O6
Trichorabdal H chemical structure, C22H28O7, CAS 20086-59-3
Trichorabdal H
CAS 20086-59-3C22H28O7
Trichorabdal A chemical structure, C20H26O5, CAS 85329-59-5
Trichorabdal A
CAS 85329-59-5C20H26O5
[7-Hydroxy-3'-(hydroxymethyl)-4',4'-dimethyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,2'-cyclohexane]-1'-yl] acetate chemical structure, C22H30O7
[7-Hydroxy-3'-(hydroxymethyl)-4',4'-dimethyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,2'-cyclohexane]-1'-yl] acetate
C22H30O7
Maoyecrystal E chemical structure, C22H30O7, CAS 675603-39-1
Maoyecrystal E
CAS 675603-39-1C22H30O7
Rabdosin B chemical structure, C24H32O8, CAS 84304-92-7
Rabdosin B
CAS 84304-92-7C24H32O8
Acetylexidonin chemical structure, C26H34O9
Acetylexidonin
C26H34O9
Acetylexidonin chemical structure, C26H34O9, CAS 116368-90-2
Acetylexidonin
CAS 116368-90-2C26H34O9
Isodonal chemical structure, C22H28O7, CAS 16964-56-0
Isodonal
CAS 16964-56-0C22H28O7
Trichorabdal B chemical structure, C22H28O7, CAS 79859-42-0
Trichorabdal B
CAS 79859-42-0C22H28O7
Trichorabdal C chemical structure, C22H28O7, CAS 85345-62-6
Trichorabdal C
CAS 85345-62-6C22H28O7
Acetylexidonin chemical structure, C26H34O9
Acetylexidonin
C26H34O9
[(1R,1'R,3'S,5S,6R,7R,9R)-7-Hydroxy-3'-(hydroxymethyl)-4',4'-dimethyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,2'-cyclohexane]-1'-yl] acetate chemical structure, C22H30O7
[(1R,1'R,3'S,5S,6R,7R,9R)-7-Hydroxy-3'-(hydroxymethyl)-4',4'-dimethyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,2'-cyclohexane]-1'-yl] acetate
C22H30O7
[(1S,1'R,2'R,5R,6S,9R)-2'-Formyl-1'-methyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,3'-cyclohexane]-1'-yl]methyl acetate chemical structure, C22H28O6, CAS 39388-60-8
[(1S,1'R,2'R,5R,6S,9R)-2'-Formyl-1'-methyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,3'-cyclohexane]-1'-yl]methyl acetate
CAS 39388-60-8C22H28O6