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Murcko scaffold

3,6,9-Trimethylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno(4,5-b)furan-2-one scaffold

15 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
17
Chemicals
15
With full pages
12
Scaffold SMILES

C=C1C(=O)OC2C1CCC(=C)C1CCC(=C)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 3,6,9-Trimethylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno(4,5-b)furan-2-one page
Murcko scaffold C=C1C(=O)OC2C1CCC(=C)C1CCC(=C)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 15 of 15 chemicals

Zaluzanin C chemical structure, C15H18O3, CAS 16838-87-2
Zaluzanin C
CAS 16838-87-2C15H18O3
(-)-Dehydrocostus lactone chemical structure, C15H18O2, CAS 477-43-0
(-)-Dehydrocostus lactone
CAS 477-43-0C15H18O2
Cynaropicrin chemical structure, C19H22O6, CAS 35730-78-0
Cynaropicrin
CAS 35730-78-0C19H22O6
Aguerin B chemical structure, C19H22O5, CAS 68370-45-6
Aguerin B
CAS 68370-45-6C19H22O5
Saupirin chemical structure, C19H22O6, CAS 35932-39-9
Saupirin
CAS 35932-39-9C19H22O6
(3aR,4R,6aR,8S,9aR,9bR)-4,8-Dihydroxy-3,6,9-trimethylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-2-one chemical structure, C15H18O4, CAS 89647-87-0
(3aR,4R,6aR,8S,9aR,9bR)-4,8-Dihydroxy-3,6,9-trimethylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-2-one
CAS 89647-87-0C15H18O4
4'-Nor-2'-methoxycynaropicrin chemical structure, C19H22O6, CAS 99543-04-1
4'-Nor-2'-methoxycynaropicrin
CAS 99543-04-1C19H22O6
Aguerin A chemical structure, C19H24O5, CAS 68370-46-7
Aguerin A
CAS 68370-46-7C19H24O5
7alpha-Hydroxydehydrocostus lactone chemical structure, C15H18O3, CAS 64225-27-0
7alpha-Hydroxydehydrocostus lactone
CAS 64225-27-0C15H18O3
Vernoflexin chemical structure, C20H24O4, CAS 57576-43-9
Vernoflexin
CAS 57576-43-9C20H24O4
Isozaluzanin C chemical structure, C15H18O3, CAS 67667-64-5
Isozaluzanin C
CAS 67667-64-5C15H18O3
3,6,9-Trimethylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno(4,5-b)furan-2-one chemical structure, C15H18O2, CAS 74299-48-2
3,6,9-Trimethylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno(4,5-b)furan-2-one
CAS 74299-48-2C15H18O2
Zaluzanin C isovalerate chemical structure, C20H26O4, CAS 72704-09-7
Zaluzanin C isovalerate
CAS 72704-09-7C20H26O4
Zaluzanin D chemical structure, C17H20O4, CAS 16838-85-0
Zaluzanin D
CAS 16838-85-0C17H20O4
Deacylcynaropicrin chemical structure, C15H18O4, CAS 31565-50-1
Deacylcynaropicrin
CAS 31565-50-1C15H18O4