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Murcko scaffold

Ring system with 3 rings and 17 atoms

13 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
17
Chemicals
13
With full pages
6
Scaffold SMILES

C=C1C(=O)OC2C=CC3=CC(=O)C(CCC12)O3

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)OC2C=CC3=CC(=O)C(CCC12)O3

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 13 of 13 chemicals

Budlein a chemical structure, C20H22O7, CAS 59481-48-0
Budlein a
CAS 59481-48-0C20H22O7
Calaxin chemical structure, C19H20O6, CAS 30412-86-3
Calaxin
CAS 30412-86-3C19H20O6
Goyazensolide chemical structure, C19H20O7, CAS 60066-35-5
Goyazensolide
CAS 60066-35-5C19H20O7
Furanohelianolide chemical structure, C20H24O6, CAS 71939-66-7
Furanohelianolide
CAS 71939-66-7C20H24O6
Lobatin B chemical structure, C20H24O7, CAS 84754-02-9
Lobatin B
CAS 84754-02-9C20H24O7
(3aS,4S,6R,11aR,Z)-10-(Hydroxymethyl)-6-methyl-3-methylene-2,7-dioxo-2,3,3a,4,5,6,7,11a-octahydro-6,9-epoxycyclodeca[b]furan-4-yl methacrylate chemical structure, C19H20O7, CAS 123563-71-3
(3aS,4S,6R,11aR,Z)-10-(Hydroxymethyl)-6-methyl-3-methylene-2,7-dioxo-2,3,3a,4,5,6,7,11a-octahydro-6,9-epoxycyclodeca[b]furan-4-yl methacrylate
CAS 123563-71-3C19H20O7
15-Deoxybudlein A chemical structure, C20H22O6, CAS 78685-07-1
15-Deoxybudlein A
CAS 78685-07-1C20H22O6
Ciliarin chemical structure, C19H22O6, CAS 30412-87-4
Ciliarin
CAS 30412-87-4C19H22O6
Lychnophorolide B chemical structure, C20H22O7, CAS 80795-28-4
Lychnophorolide B
CAS 80795-28-4C20H22O7
Centratherin chemical structure, C20H22O7, CAS 71939-83-8
Centratherin
CAS 71939-83-8C20H22O7
Lychnopholide chemical structure, C20H22O6, CAS 77448-64-7
Lychnopholide
CAS 77448-64-7C20H22O6
(3aR,4R,6R,11aR,Z)-10-(Hydroxymethyl)-6-methyl-3-methylene-2,7-dioxo-2,3,3a,4,5,6,7,11a-octahydro-6,9-epoxycyclodeca[b]furan-4-yl methacrylate chemical structure, C19H20O7, CAS 75642-92-1
(3aR,4R,6R,11aR,Z)-10-(Hydroxymethyl)-6-methyl-3-methylene-2,7-dioxo-2,3,3a,4,5,6,7,11a-octahydro-6,9-epoxycyclodeca[b]furan-4-yl methacrylate
CAS 75642-92-1C19H20O7
[(2Z)-2,11-Dimethyl-7-methylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.04,8]tetradeca-1(13),2-dien-9-yl] (E)-4-acetyloxy-2-methylbut-2-enoate chemical structure, C22H24O8, CAS 80453-38-9
[(2Z)-2,11-Dimethyl-7-methylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.04,8]tetradeca-1(13),2-dien-9-yl] (E)-4-acetyloxy-2-methylbut-2-enoate
CAS 80453-38-9C22H24O8