CompoundList
Sign in
Murcko scaffold

Ring system with 4 rings and 18 atoms

8 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
18
Chemicals
8
With full pages
3
Scaffold SMILES

C=C1CCC2c3[nH]c4ccccc4c3CCN2C1

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=C1CCC2c3[nH]c4ccccc4c3CCN2C1

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 8 of 8 chemicals

Isositsirikine chemical structure, C21H26N2O3, CAS 6519-27-3
Isositsirikine
CAS 6519-27-3C21H26N2O3
Indolo(2,3-a)quinolizine-2-acetic acid, 3-ethylidene-1,2,3,4,6,7,12,12b-octahydro-alpha-(hydroxymethyl)-, methyl ester, (alphaS,2R,3Z,12bS)- chemical structure, C21H26N2O3, CAS 80287-16-7
Indolo(2,3-a)quinolizine-2-acetic acid, 3-ethylidene-1,2,3,4,6,7,12,12b-octahydro-alpha-(hydroxymethyl)-, methyl ester, (alphaS,2R,3Z,12bS)-
CAS 80287-16-7C21H26N2O3
Epiisositsirikine chemical structure, C21H26N2O3, CAS 60031-91-6
Epiisositsirikine
CAS 60031-91-6C21H26N2O3
Geissoschizine methyl ether chemical structure, C22H26N2O3, CAS 60314-89-8
Geissoschizine methyl ether
CAS 60314-89-8C22H26N2O3
Methyl (alphaZ,2S,3E,12bS)-3-ethylidene-1,2,3,4,6,7,12,12b-octahydro-alpha-(hydroxymethylene)indolo(2,3-a)quinolizine-2-acetate chemical structure, C21H24N2O3, CAS 439-66-7
Methyl (alphaZ,2S,3E,12bS)-3-ethylidene-1,2,3,4,6,7,12,12b-octahydro-alpha-(hydroxymethylene)indolo(2,3-a)quinolizine-2-acetate
CAS 439-66-7C21H24N2O3
Villocarine A chemical structure, C22H26N2O3, CAS 1319743-81-1
Villocarine A
CAS 1319743-81-1C22H26N2O3
Diploceline chemical structure, C22H29N2O3+, CAS 69306-89-4
Diploceline
CAS 69306-89-4C22H29N2O3+
9-Methoxygeissoschizol chemical structure, C20H26N2O2, CAS 184303-35-3
9-Methoxygeissoschizol
CAS 184303-35-3C20H26N2O2