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Murcko scaffold

Ring system with 10 rings and 39 atoms

9 chemicals on CompoundList share this ring system.

Rings
10
Scaffold atoms
39
Chemicals
9
With full pages
3
Scaffold SMILES

C1=CC2CCC3Nc4ccc(C5CC6CN(CCc7c5[nH]c5ccccc75)CC5OC65)cc4C34CCN(C1)C24

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 C1=CC2CCC3Nc4ccc(C5CC6CN(CCc7c5[nH]c5ccccc75)CC5OC65)cc4C34CCN(C1)C24

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

Vincaleukoblastine, 4'-deoxy-3',4'-epoxy-12'-hydroxy-, (3'alpha,4'alpha)- chemical structure, C46H56N4O10, CAS 79257-03-7
Vincaleukoblastine, 4'-deoxy-3',4'-epoxy-12'-hydroxy-, (3'alpha,4'alpha)-
CAS 79257-03-7C46H56N4O10
Leurosine sulfate chemical structure, C46H58N4O13S
Leurosine sulfate
C46H58N4O13S
Leurosine chemical structure, C46H56N4O9, CAS 23360-92-1
Leurosine
CAS 23360-92-1C46H56N4O9
Vincaleukoblastine, 4'-deoxy-3',4'-epoxy-, (3'alpha,4'alpha)- chemical structure, C46H56N4O9, CAS 1404-95-1
Vincaleukoblastine, 4'-deoxy-3',4'-epoxy-, (3'alpha,4'alpha)-
CAS 1404-95-1C46H56N4O9
O~3'~,3'-Cyclovincaleukoblastine chemical structure, C46H56N4O9, CAS 11032-39-6
O~3'~,3'-Cyclovincaleukoblastine
CAS 11032-39-6C46H56N4O9
Vinleurosine sulfate chemical structure, C92H114N8O22S, CAS 54081-68-4
Vinleurosine sulfate
CAS 54081-68-4C92H114N8O22S
Vinformide chemical structure, C46H54N4O10, CAS 54022-49-0
Vinformide
CAS 54022-49-0C46H54N4O10
Pleurosine chemical structure, C46H56N4O10, CAS 39608-80-5
Pleurosine
CAS 39608-80-5C46H56N4O10
Vincaleukoblastine, O4-deacetyl-3-de(methoxycarbonyl)-4a(2)-deoxy-3-[[[(1S)-1-(diethoxyphosphinyl)-2-methylpropyl]amino]carbonyl]-3a(2),4a(2)-epoxy-, 6a(2)-oxide, (3a(2)R,4a(2)S)- chemical structure, C51H70N5O11P, CAS 1207727-31-8
Vincaleukoblastine, O4-deacetyl-3-de(methoxycarbonyl)-4a(2)-deoxy-3-[[[(1S)-1-(diethoxyphosphinyl)-2-methylpropyl]amino]carbonyl]-3a(2),4a(2)-epoxy-, 6a(2)-oxide, (3a(2)R,4a(2)S)-
CAS 1207727-31-8C51H70N5O11P