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Murcko scaffold

Ring system with 2 rings and 26 atoms

12 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
26
Chemicals
12
With full pages
6
Scaffold SMILES

c1ccc(CCCCOCCCCCCNCCc2ccccc2)cc1

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 c1ccc(CCCCOCCCCCCNCCc2ccccc2)cc1

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 12 of 12 chemicals

Salmeterol chemical structure, C25H37NO4, CAS 89365-50-4
Salmeterol
CAS 89365-50-4C25H37NO4
Salmeterol xinafoate chemical structure, C36H45NO7, CAS 94749-08-3
Salmeterol xinafoate
CAS 94749-08-3C36H45NO7
alpha-Hydroxysalmeterol chemical structure, C25H37NO5, CAS 152405-02-2
alpha-Hydroxysalmeterol
CAS 152405-02-2C25H37NO5
(R)-Salmeterol chemical structure, C25H37NO4, CAS 135271-47-5
(R)-Salmeterol
CAS 135271-47-5C25H37NO4
(S)-Salmeterol chemical structure, C25H37NO4, CAS 135271-48-6
(S)-Salmeterol
CAS 135271-48-6C25H37NO4
GW-597901 chemical structure, C25H38N2O6S, CAS 452339-68-3
GW-597901
CAS 452339-68-3C25H38N2O6S
Salmeterol-d3 chemical structure, C25H37NO4, CAS 497063-94-2
Salmeterol-d3
CAS 497063-94-2C25H37NO4
4-[(1R)-2-[[4,4-Difluoro-6-(4-phenylbutoxy)hexyl]amino]-1-hydroxyethyl]-2-(hydroxymethyl)phenol chemical structure, C25H35F2NO4, CAS 915133-67-4
4-[(1R)-2-[[4,4-Difluoro-6-(4-phenylbutoxy)hexyl]amino]-1-hydroxyethyl]-2-(hydroxymethyl)phenol
CAS 915133-67-4C25H35F2NO4
GW-597901 cinnamate chemical structure, C34H46N2O8S, CAS 1144522-84-8
GW-597901 cinnamate
CAS 1144522-84-8C34H46N2O8S
tert-Butyl 2-hydroxy-2-(4-hydroxy-3-(hydroxymethyl)phenyl)ethyl(6-(4-phenylbutoxy)hexyl)carbamate chemical structure, C30H45NO6, CAS 917480-05-8
tert-Butyl 2-hydroxy-2-(4-hydroxy-3-(hydroxymethyl)phenyl)ethyl(6-(4-phenylbutoxy)hexyl)carbamate
CAS 917480-05-8C30H45NO6
3-De(hydroxymethyl)-3-methyl salmeterol chemical structure, C25H37NO3, CAS 1391054-40-2
3-De(hydroxymethyl)-3-methyl salmeterol
CAS 1391054-40-2C25H37NO3
Salmeterol nitrosamine impurity chemical structure, C25H36N2O5, CAS 3036581-81-1
Salmeterol nitrosamine impurity
CAS 3036581-81-1C25H36N2O5