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Murcko scaffold

Ring system with 3 rings and 39 atoms

5 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
39
Chemicals
5
With full pages
1
Scaffold SMILES

O=C1CCCCCNC(=O)C(Cc2ccccc2)NC(=O)CNC(=O)C(CCc2ccccc2)NC(=O)CN1

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=C1CCCCCNC(=O)C(Cc2ccccc2)NC(=O)CNC(=O)C(CCc2ccccc2)NC(=O)CN1

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 5 of 5 chemicals

Anabaenopeptin B chemical structure, C41H60N10O9, CAS 161897-74-1
Anabaenopeptin B
CAS 161897-74-1C41H60N10O9
Oscillamide B chemical structure, C41H60N10O9S, CAS 365400-06-2
Oscillamide B
CAS 365400-06-2C41H60N10O9S
Schizopeptin 791 chemical structure, C42H61N7O8, CAS 455951-71-0
Schizopeptin 791
CAS 455951-71-0C42H61N7O8
Anabaenopeptin F chemical structure, C42H62N10O9, CAS 226416-60-0
Anabaenopeptin F
CAS 226416-60-0C42H62N10O9
N~2~-{[(3S,6S,9S,12S,15R)-3-Benzyl-9-[2-(4-hydroxyphenyl)ethyl]-6,7-dimethyl-2,5,8,11,14-pentaoxo-12-(propan-2-yl)-1,4,7,10,13-pentaazacyclononadecan-15-yl]carbamoyl}-N~6~-carbamimidoyl-L-lysine chemical structure, C42H62N10O9, CAS 1309875-12-4
N~2~-{[(3S,6S,9S,12S,15R)-3-Benzyl-9-[2-(4-hydroxyphenyl)ethyl]-6,7-dimethyl-2,5,8,11,14-pentaoxo-12-(propan-2-yl)-1,4,7,10,13-pentaazacyclononadecan-15-yl]carbamoyl}-N~6~-carbamimidoyl-L-lysine
CAS 1309875-12-4C42H62N10O9