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Murcko scaffold

Pityriacitrin scaffold

5 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
24
Chemicals
5
With full pages
3
Scaffold SMILES

O=C(c1c[nH]c2ccccc12)c1nccc2c1[nH]c1ccccc12

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 Pityriacitrin page
Murcko scaffold O=C(c1c[nH]c2ccccc12)c1nccc2c1[nH]c1ccccc12

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 5 of 5 chemicals

Hyrtiosulawesine chemical structure, C20H13N3O3, CAS 452067-33-3
Hyrtiosulawesine
CAS 452067-33-3C20H13N3O3
Pityriacitrin chemical structure, C20H13N3O, CAS 244295-64-5
Pityriacitrin
CAS 244295-64-5C20H13N3O
Pityriacitrin B chemical structure, C21H13N3O3, CAS 863766-95-4
Pityriacitrin B
CAS 863766-95-4C21H13N3O3
Methyl 1-(1H-indole-3-carbonyl)-9H-pyrido[3,4-b]indole-3-carboxylate chemical structure, C22H15N3O3, CAS 1350653-04-1
Methyl 1-(1H-indole-3-carbonyl)-9H-pyrido[3,4-b]indole-3-carboxylate
CAS 1350653-04-1C22H15N3O3
(1H-Indol-3-yl)(7-methoxy-9H-pyrido[3,4-b]indol-1-yl)methanone chemical structure, C21H15N3O2, CAS 1367322-74-4
(1H-Indol-3-yl)(7-methoxy-9H-pyrido[3,4-b]indol-1-yl)methanone
CAS 1367322-74-4C21H15N3O2