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Murcko scaffold

Ring system with 4 rings and 23 atoms

14 chemicals on CompoundList share this ring system.

Rings: 4
Scaffold atoms: 23
Chemicals: 14
With full pages: 7

Scaffold SMILES

O=c1c(OC2CCCO2)c(-c2ccccc2)oc2ccccc12

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(OC2CCCO2)c(-c2ccccc2)oc2ccccc12

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 14 of 14 chemicals

Juglanin chemical structure, C20H18O10, CAS 5041-67-8

CAS 5041-67-8C₂₀H₁₈O₁₀

Isoquercitrin chemical structure, C21H20O12, CAS 21637-25-2

CAS 21637-25-2C₂₁H₂₀O₁₂

Quercetin-3-arabinofuranoside chemical structure, C20H18O11, CAS 168293-37-6

Quercetin-3-arabinofuranoside

CAS 168293-37-6C₂₀H₁₈O₁₁

Avicularin chemical structure, C20H18O11, CAS 572-30-5

CAS 572-30-5C₂₀H₁₈O₁₁

Isohyperoside chemical structure, C21H20O12, CAS 35589-21-0

CAS 35589-21-0C₂₁H₂₀O₁₂

Quercetin 3-arabinoside chemical structure, C20H18O11, CAS 30370-87-7

Quercetin 3-arabinoside

CAS 30370-87-7C₂₀H₁₈O₁₁

Quercetin 3-O-alpha-D-arabinofuranoside chemical structure, C20H18O11, CAS 960511-32-4

Quercetin 3-O-alpha-D-arabinofuranoside

CAS 960511-32-4C₂₀H₁₈O₁₁

Avicularine chemical structure, C20H18O11, CAS 5041-68-9

CAS 5041-68-9C₂₀H₁₈O₁₁

Myricetin 3-arabinofuranoside chemical structure, C20H18O12, CAS 1198767-93-9

Myricetin 3-arabinofuranoside

CAS 1198767-93-9C₂₀H₁₈O₁₂

Myricetin 3-alpha-L-arabinofuranoside chemical structure, C20H18O12, CAS 35589-22-1

Myricetin 3-alpha-L-arabinofuranoside

CAS 35589-22-1C₂₀H₁₈O₁₂

3-[(3S,4R,5R)-3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one chemical structure, C20H18O11, CAS 72581-58-9

3-[(3S,4R,5R)-3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one

CAS 72581-58-9C₂₀H₁₈O₁₁

5''-O-Acetyljuglanin chemical structure, C22H20O11, CAS 885697-82-5

5''-O-Acetyljuglanin

CAS 885697-82-5C₂₂H₂₀O₁₁

Boehmerin chemical structure, C22H20O12, CAS 54716-89-1

CAS 54716-89-1C₂₂H₂₀O₁₂

3-((6-Deoxy-alpha-L-mannofuranosyl)oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one chemical structure, C21H20O10, CAS 5041-73-6

3-((6-Deoxy-alpha-L-mannofuranosyl)oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

CAS 5041-73-6C₂₁H₂₀O₁₀