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Murcko scaffold

Ring system with 4 rings and 21 atoms

9 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
21
Chemicals
9
With full pages
3
Scaffold SMILES

O=c1ccc2ccc3c(c2o1)OCC(c1ccccc1)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 O=c1ccc2ccc3c(c2o1)OCC(c1ccccc1)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 9 of 9 chemicals

Daphneticin chemical structure, C20H18O8, CAS 83327-22-4
Daphneticin
CAS 83327-22-4C20H18O8
Cleomiscosin A chemical structure, C20H18O8, CAS 76948-72-6
Cleomiscosin A
CAS 76948-72-6C20H18O8
8'-Epi-cleomiscosin A chemical structure, C20H18O8, CAS 848366-79-0
8'-Epi-cleomiscosin A
CAS 848366-79-0C20H18O8
Cleomiscosin C chemical structure, C21H20O9, CAS 84575-10-0
Cleomiscosin C
CAS 84575-10-0C21H20O9
5-Chloropropacin chemical structure, C20H17ClO7, CAS 851724-28-2
5-Chloropropacin
CAS 851724-28-2C20H17ClO7
Isodaphneticin chemical structure, C19H16O7, CAS 477770-78-8
Isodaphneticin
CAS 477770-78-8C19H16O7
5'-Demethylaquillochin chemical structure, C20H18O9, CAS 305364-91-4
5'-Demethylaquillochin
CAS 305364-91-4C20H18O9
6-Demethoxy-9'-deoxycleomiscosin A chemical structure, C19H16O6, CAS 121587-18-6
6-Demethoxy-9'-deoxycleomiscosin A
CAS 121587-18-6C19H16O6
(2R,3R)-3-(4-Hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-9-one chemical structure, C19H16O7, CAS 121587-20-0
(2R,3R)-3-(4-Hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-9-one
CAS 121587-20-0C19H16O7