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Murcko scaffold

Ring system with 8 rings and 35 atoms

4 chemicals on CompoundList share this ring system.

Rings
8
Scaffold atoms
35
Chemicals
4
With full pages
1
Scaffold SMILES

C1=CC2CCC3Nc4ccc(C5CCCNCCc6c5[nH]c5ccccc65)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(C5CCCNCCc6c5[nH]c5ccccc65)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 4 of 4 chemicals

Methyl (1R,9R,10S,11R,12R,19R)-11-acetyloxy-12-ethyl-8-formyl-10-hydroxy-5-methoxy-4-[(5S,7S)-7-methoxycarbonyl-5-(2-oxobutyl)-2,3,4,5,6,8-hexahydro-1H-azonino[5,4-b]indol-7-yl]-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10-carboxylate chemical structure, C45H54N4O10, CAS 910580-56-2
Methyl (1R,9R,10S,11R,12R,19R)-11-acetyloxy-12-ethyl-8-formyl-10-hydroxy-5-methoxy-4-[(5S,7S)-7-methoxycarbonyl-5-(2-oxobutyl)-2,3,4,5,6,8-hexahydro-1H-azonino[5,4-b]indol-7-yl]-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10-carboxylate
CAS 910580-56-2C45H54N4O10
Catharinine chemical structure, C46H56N4O10, CAS 58511-83-4
Catharinine
CAS 58511-83-4C46H56N4O10
Vincristine metabolite M1 chemical structure, C45H54N4O10, CAS 1292904-64-3
Vincristine metabolite M1
CAS 1292904-64-3C45H54N4O10
Vincristine metabolite M2 chemical structure, C47H56N4O11, CAS 910580-58-4
Vincristine metabolite M2
CAS 910580-58-4C47H56N4O11