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Murcko scaffold

Ring system with 3 rings and 16 atoms

17 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
16
Chemicals
17
With full pages
6
Scaffold SMILES

C=C1C(=O)OC2CCC3CCC(=O)C3CC12

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=C1C(=O)OC2CCC3CCC(=O)C3CC12

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 17 of 17 chemicals

2,3-Dihydrohelenalin chemical structure, C15H20O4, CAS 35412-73-8
2,3-Dihydrohelenalin
CAS 35412-73-8C15H20O4
(3aR,4aS,7aS,8S,9aR)-Decahydro-4a,8-dimethyl-3-methyleneazuleno(6,5-b)furan-2,5-dione chemical structure, C15H20O3, CAS 19908-69-1
(3aR,4aS,7aS,8S,9aR)-Decahydro-4a,8-dimethyl-3-methyleneazuleno(6,5-b)furan-2,5-dione
CAS 19908-69-1C15H20O3
Burrodin chemical structure, C15H20O4, CAS 20555-02-6
Burrodin
CAS 20555-02-6C15H20O4
(3aS,5R,5aR,8aR,9aS)-5,8a-Dimethyl-1-methylidene-3a,4,5,5a,6,7,9,9a-octahydroazuleno[6,7-b]furan-2,8-dione chemical structure, C15H20O3, CAS 60426-81-5
(3aS,5R,5aR,8aR,9aS)-5,8a-Dimethyl-1-methylidene-3a,4,5,5a,6,7,9,9a-octahydroazuleno[6,7-b]furan-2,8-dione
CAS 60426-81-5C15H20O3
Ergolide chemical structure, C17H22O5, CAS 54999-07-4
Ergolide
CAS 54999-07-4C17H22O5
Carpesiolin chemical structure, C15H20O4, CAS 63568-73-0
Carpesiolin
CAS 63568-73-0C15H20O4
Graveolide chemical structure, C15H20O3, CAS 72173-44-5
Graveolide
CAS 72173-44-5C15H20O3
Peruvin chemical structure, C15H20O4, CAS 6617-45-4
Peruvin
CAS 6617-45-4C15H20O4
(1S,2R,5R,6S,7S,8S,10R)-6-Hydroxy-2-ethoxy-4-oxopseudoguai-11(13)-en-12,8-olide chemical structure, C17H24O5, CAS 1333396-71-6
(1S,2R,5R,6S,7S,8S,10R)-6-Hydroxy-2-ethoxy-4-oxopseudoguai-11(13)-en-12,8-olide
CAS 1333396-71-6C17H24O5
(1S,2R,5R,6S,7R,8S,10R)-6-Acetoxy-2-methoxy-4-oxopseudoguai-11(13)-en-12,8-olide chemical structure, C18H24O6, CAS 1333396-72-7
(1S,2R,5R,6S,7R,8S,10R)-6-Acetoxy-2-methoxy-4-oxopseudoguai-11(13)-en-12,8-olide
CAS 1333396-72-7C18H24O6
(1S,2S,5R,6S,7R,8S,10R)-6-Acetoxy-2-methoxy-4-oxopseudoguai-11(13)-en-12,8-olide chemical structure, C18H24O6, CAS 1333396-73-8
(1S,2S,5R,6S,7R,8S,10R)-6-Acetoxy-2-methoxy-4-oxopseudoguai-11(13)-en-12,8-olide
CAS 1333396-73-8C18H24O6
(1S,5S,7R,8S,10R)-14-Acetoxy-4-oxopseudoguai-11(13)-en-12,8-olide chemical structure, C17H22O5, CAS 1333396-69-2
(1S,5S,7R,8S,10R)-14-Acetoxy-4-oxopseudoguai-11(13)-en-12,8-olide
CAS 1333396-69-2C17H22O5
(1S,2R,5R,6S,7S,8S,10R)-6-Hydroxy-2-methoxy-4-oxopseudoguai-11(13)-en-12,8-olide chemical structure, C16H22O5, CAS 1333396-70-5
(1S,2R,5R,6S,7S,8S,10R)-6-Hydroxy-2-methoxy-4-oxopseudoguai-11(13)-en-12,8-olide
CAS 1333396-70-5C16H22O5
Allodesacetylconfertiflorin chemical structure, C15H20O4, CAS 17235-05-1
Allodesacetylconfertiflorin
CAS 17235-05-1C15H20O4
8-Methyl-3-methylidenedecahydroazuleno[6,5-b]furan-2,5-dione chemical structure, C14H18O3, CAS 61465-30-3
8-Methyl-3-methylidenedecahydroazuleno[6,5-b]furan-2,5-dione
CAS 61465-30-3C14H18O3
2-Butanoic acid, 2-methyl-, dodecahydro-7-hydroxy-4a,8-dimethyl-3-methylene-2,5-dioxoazuleno(6,5-b)furan-4-yl ester chemical structure, C20H26O6, CAS 25644-08-0
2-Butanoic acid, 2-methyl-, dodecahydro-7-hydroxy-4a,8-dimethyl-3-methylene-2,5-dioxoazuleno(6,5-b)furan-4-yl ester
CAS 25644-08-0C20H26O6
Arnifolin B chemical structure, C20H26O6, CAS 113430-33-4
Arnifolin B
CAS 113430-33-4C20H26O6