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Murcko scaffold

Ring system with 5 rings and 27 atoms

13 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
27
Chemicals
13
With full pages
1
Scaffold SMILES

O=C1CCc2ncccc2C(=O)OCC2OC34CC(CCC3CCC2C4)O1

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=C1CCc2ncccc2C(=O)OCC2OC34CC(CCC3CCC2C4)O1

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

Euonymine chemical structure, C38H47NO18
Euonymine
C38H47NO18
Neoeuonymine chemical structure, C36H45NO17
Neoeuonymine
C36H45NO17
Euonymine chemical structure, C38H47NO18
Euonymine
C38H47NO18
Neoeuonymine chemical structure, C36H45NO17, CAS 33510-25-7
Neoeuonymine
CAS 33510-25-7C36H45NO17
Euonymine chemical structure, C38H47NO18, CAS 33458-82-1
Euonymine
CAS 33458-82-1C38H47NO18
[(1S,3R,13S,14R,17S,18R,19R,20R,21S,22R,23R,24R,25S)-18,19,21,22,24-Pentaacetyloxy-25-hydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-20-yl]methyl acetate chemical structure, C38H47NO18
[(1S,3R,13S,14R,17S,18R,19R,20R,21S,22R,23R,24R,25S)-18,19,21,22,24-Pentaacetyloxy-25-hydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-20-yl]methyl acetate
C38H47NO18
Euonymine chemical structure, C38H47NO18, CAS 150881-01-9
Euonymine
CAS 150881-01-9C38H47NO18
Aquifoliunine E-III chemical structure, C36H45NO17
Aquifoliunine E-III
C36H45NO17
Aquifoliunine EIII chemical structure, C36H45NO17, CAS 220751-20-2
Aquifoliunine EIII
CAS 220751-20-2C36H45NO17
Aquifoliunine E-III chemical structure, C36H45NO17
Aquifoliunine E-III
C36H45NO17
Tripterygiumine H chemical structure, C28H37NO13, CAS 73257-63-3
Tripterygiumine H
CAS 73257-63-3C28H37NO13
[(1R,3S,13R,14R,17R,18S,19S,20S,21R,22S,23R,24S,25R)-18,19,21,22-Tetraacetyloxy-24,25-dihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-20-yl]methyl acetate chemical structure, C36H45NO17
[(1R,3S,13R,14R,17R,18S,19S,20S,21R,22S,23R,24S,25R)-18,19,21,22-Tetraacetyloxy-24,25-dihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-20-yl]methyl acetate
C36H45NO17
Orb2564083 chemical structure, C36H45NO17
Orb2564083
C36H45NO17