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Murcko scaffold

Rutaecarpine scaffold

8 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
22
Chemicals
8
With full pages
3
Scaffold SMILES

O=c1c2ccccc2nc2n1CCc1c-2[nH]c2ccccc12

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 scaffoldOpen the Rutaecarpine page
Murcko scaffold O=c1c2ccccc2nc2n1CCc1c-2[nH]c2ccccc12

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

Rutaecarpine chemical structure, C18H13N3O, CAS 84-26-4
Rutaecarpine
CAS 84-26-4C18H13N3O
Dehydroevodiamine chloride chemical structure, C19H16ClN3O, CAS 75853-60-0
Dehydroevodiamine chloride
CAS 75853-60-0C19H16ClN3O
3-Hydroxyrutaecarpine chemical structure, C18H13N3O2, CAS 381723-48-4
3-Hydroxyrutaecarpine
CAS 381723-48-4C18H13N3O2
1-Hydroxyrutaecarpine chemical structure, C18H13N3O2, CAS 53600-24-1
1-Hydroxyrutaecarpine
CAS 53600-24-1C18H13N3O2
7beta-Hydroxyrutaecarpine chemical structure, C18H13N3O2, CAS 163815-35-8
7beta-Hydroxyrutaecarpine
CAS 163815-35-8C18H13N3O2
3-(5-Oxo-7,8-dihydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-13(5H)-yl)propanoic acid chemical structure, C21H17N3O3, CAS 1630763-83-5
3-(5-Oxo-7,8-dihydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-13(5H)-yl)propanoic acid
CAS 1630763-83-5C21H17N3O3
Orisuaveoline A chemical structure, C18H13N3O2, CAS 1105671-13-3
Orisuaveoline A
CAS 1105671-13-3C18H13N3O2
12-Chloro-8,13-dihydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(7H)-one chemical structure, C18H12ClN3O, CAS 912341-59-4
12-Chloro-8,13-dihydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(7H)-one
CAS 912341-59-4C18H12ClN3O