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Murcko scaffold

9-Phenyl-3a,4,9,9a-tetrahydronaphtho[2,3-c]furan-1(3H)-one scaffold

6 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
20
Chemicals
6
With full pages
1
Scaffold SMILES

O=C1OCC2Cc3ccccc3C(c3ccccc3)C12

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 9-Phenyl-3a,4,9,9a-tetrahydronaphtho[2,3-c]furan-1(3H)-one page
Murcko scaffold O=C1OCC2Cc3ccccc3C(c3ccccc3)C12

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 6 of 6 chemicals

4-Demethyl-6,7-demethylene-1-epipodophyllotoxin chemical structure, C20H20O8, CAS 138456-91-4
4-Demethyl-6,7-demethylene-1-epipodophyllotoxin
CAS 138456-91-4C20H20O8
Naphtho(2,3-c)furan-1(3H)-one, 3a,4,9,9a-tetrahydro-4,6,7-trihydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-, (3aR,4R,9R,9aR)- chemical structure, C20H20O8, CAS 138456-90-3
Naphtho(2,3-c)furan-1(3H)-one, 3a,4,9,9a-tetrahydro-4,6,7-trihydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-, (3aR,4R,9R,9aR)-
CAS 138456-90-3C20H20O8
Podophyllotoxin impurity 5 chemical structure, C21H22O8, CAS 1174-97-6
Podophyllotoxin impurity 5
CAS 1174-97-6C21H22O8
Sikkimotoxin chemical structure, C23H26O8, CAS 18651-67-7
Sikkimotoxin
CAS 18651-67-7C23H26O8
6,7-Demethylenedeoxypodophyllotoxin chemical structure, C21H22O7, CAS 1173-42-8
6,7-Demethylenedeoxypodophyllotoxin
CAS 1173-42-8C21H22O7
9-Phenyl-3a,4,9,9a-tetrahydronaphtho[2,3-c]furan-1(3H)-one chemical structure, C18H16O2, CAS 61019-11-2
9-Phenyl-3a,4,9,9a-tetrahydronaphtho[2,3-c]furan-1(3H)-one
CAS 61019-11-2C18H16O2