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Murcko scaffold

Ring system with 4 rings and 24 atoms

10 chemicals on CompoundList share this ring system.

Rings: 4
Scaffold atoms: 24
Chemicals: 10
With full pages: 4

Scaffold SMILES

O=c1c(-c2ccc(OC3CCCCO3)cc2)coc2ccccc12

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=c1c(-c2ccc(OC3CCCCO3)cc2)coc2ccccc12

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 10 of 10 chemicals

Sophoricoside chemical structure, C21H20O10, CAS 152-95-4

CAS 152-95-4C₂₁H₂₀O₁₀

4-(7-Ethoxy-5-hydroxy-4-oxo-4H-chromen-3-yl)phenyl hexopyranoside chemical structure, C23H24O10, CAS 4555-51-5

4-(7-Ethoxy-5-hydroxy-4-oxo-4H-chromen-3-yl)phenyl hexopyranoside

CAS 4555-51-5C₂₃H₂₄O₁₀

Prunetin 4'-O-glucoside chemical structure, C22H22O10, CAS 154-36-9

Prunetin 4'-O-glucoside

CAS 154-36-9C₂₂H₂₂O₁₀

Daidzein 4'-O-glucuronide chemical structure, C21H18O10, CAS 264236-77-3

Daidzein 4'-O-glucuronide

CAS 264236-77-3C₂₁H₁₈O₁₀

5,7-Dimethoxy-3-(4-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)-4H-chromen-4-one chemical structure, C23H24O10, CAS 1173199-68-2

5,7-Dimethoxy-3-(4-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)-4H-chromen-4-one

CAS 1173199-68-2C₂₃H₂₄O₁₀

4-(5,7-Dihydroxy-4-oxo-4H-1-benzopyran-3-yl)phenyl beta-D-glucopyranosiduronic acid chemical structure, C21H18O11, CAS 245084-07-5

4-(5,7-Dihydroxy-4-oxo-4H-1-benzopyran-3-yl)phenyl beta-D-glucopyranosiduronic acid

CAS 245084-07-5C₂₁H₁₈O₁₁

Daidzein-4'-glucoside chemical structure, C21H20O9, CAS 58970-69-7

Daidzein-4'-glucoside

CAS 58970-69-7C₂₁H₂₀O₉

Genistein 4'-glucuronide-7-sulfate chemical structure, C21H18O14S, CAS 1630724-68-3

Genistein 4'-glucuronide-7-sulfate

CAS 1630724-68-3C₂₁H₁₈O₁₄S

Demethyltexasin 4'-O-glucoside chemical structure, C21H20O10, CAS 34307-23-8

Demethyltexasin 4'-O-glucoside

CAS 34307-23-8C₂₁H₂₀O₁₀

7-Methyl-tectorigenin-4'-O-beta-D-glucopyranoside chemical structure, C23H24O11, CAS 19316-92-8

7-Methyl-tectorigenin-4'-O-beta-D-glucopyranoside

CAS 19316-92-8C₂₃H₂₄O₁₁