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Murcko scaffold

Ring system with 6 rings and 28 atoms

8 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
28
Chemicals
8
With full pages
1
Scaffold SMILES

C=C1C=C2C=c3cc4c([nH]3)=C(CC4=O)C3=NC(=CC4=NC(=CC1=N2)C=C4)CC3

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 C=C1C=C2C=c3cc4c([nH]3)=C(CC4=O)C3=NC(=CC4=NC(=CC1=N2)C=C4)CC3

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 8 of 8 chemicals

Copper(2+) [9-ethenyl-14-ethyl-21-(methoxycarbonyl)-4,8,18-trimethyl-20-oxo-3-{3-oxo-3-[(3,7,11,15-tetramethylhexadec-2-en-1-yl)oxy]propyl}-23,25-didehydro-3,4,20,21-tetrahydro-13H-phorbin-25-id-13-ylidene]methanolate chemical structure, C55H70CuN4O6
Copper(2+) [9-ethenyl-14-ethyl-21-(methoxycarbonyl)-4,8,18-trimethyl-20-oxo-3-{3-oxo-3-[(3,7,11,15-tetramethylhexadec-2-en-1-yl)oxy]propyl}-23,25-didehydro-3,4,20,21-tetrahydro-13H-phorbin-25-id-13-ylidene]methanolate
C55H70CuN4O6
RefChem:128805 chemical structure, C34H28CuN4Na2O6, CAS 73836-75-6
RefChem:128805
CAS 73836-75-6C34H28CuN4Na2O6
RefChem:128804 chemical structure, C34H28CuK2N4O6, CAS 72953-55-0
RefChem:128804
CAS 72953-55-0C34H28CuK2N4O6
Magnesium [9-ethenyl-14-ethyl-21-(methoxycarbonyl)-3-(3-methoxy-3-oxopropyl)-4,8,18-trimethyl-20-oxo-23,25-didehydro-3,4,20,21-tetrahydro-13H-phorbin-25-id-13-ylidene]methanolate chemical structure, C36H34MgN4O6
Magnesium [9-ethenyl-14-ethyl-21-(methoxycarbonyl)-3-(3-methoxy-3-oxopropyl)-4,8,18-trimethyl-20-oxo-23,25-didehydro-3,4,20,21-tetrahydro-13H-phorbin-25-id-13-ylidene]methanolate
C36H34MgN4O6
Copper [16-ethenyl-11-ethyl-3-methoxycarbonyl-17,21,26-trimethyl-4-oxo-22-[3-oxo-3-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,24,25-triaza-7-azanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),5(26),8,10,13(25),14,16,18(24),19-decaen-12-ylidene]methanolate chemical structure, C55H70CuN4O6
Copper [16-ethenyl-11-ethyl-3-methoxycarbonyl-17,21,26-trimethyl-4-oxo-22-[3-oxo-3-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,24,25-triaza-7-azanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),5(26),8,10,13(25),14,16,18(24),19-decaen-12-ylidene]methanolate
C55H70CuN4O6
Copper-pheophytin B chemical structure, C55H70CuN4O6, CAS 24111-17-9
Copper-pheophytin B
CAS 24111-17-9C55H70CuN4O6
Zinc chlorophyll b chemical structure, C55H70N4O6Zn, CAS 22088-19-3
Zinc chlorophyll b
CAS 22088-19-3C55H70N4O6Zn
Methylchlorophyllide B chemical structure, C36H34MgN4O6, CAS 14057-06-8
Methylchlorophyllide B
CAS 14057-06-8C36H34MgN4O6