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Murcko scaffold

Ring system with 6 rings and 26 atoms

10 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
26
Chemicals
10
With full pages
1
Scaffold SMILES

C1=CC2=NC1=Cc1cc3c([nH]1)=C(CC=3)C1=NC(=CC3=NC(=C2)C=C3)CC1

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=CC2=NC1=Cc1cc3c([nH]1)=C(CC=3)C1=NC(=CC3=NC(=C2)C=C3)CC1

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 10 of 10 chemicals

RefChem:579552 chemical structure, C35H34CuN4O5, CAS 19426-70-1
RefChem:579552
CAS 19426-70-1C35H34CuN4O5
Copper(2+) potassium 3-(2-carboxylatoethyl)-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-23,25-didehydrophorbine-24,25-diide-21-carboxylate (1/2/1) chemical structure, C34H30CuK2N4O5, CAS 72984-32-8
Copper(2+) potassium 3-(2-carboxylatoethyl)-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-23,25-didehydrophorbine-24,25-diide-21-carboxylate (1/2/1)
CAS 72984-32-8C34H30CuK2N4O5
Copper chlorphyllin chemical structure, C33H28Cu2N4O5, CAS 28849-57-2
Copper chlorphyllin
CAS 28849-57-2C33H28Cu2N4O5
Copper chlorophyll sodium chemical structure, C34H30CuN4Na2O5, CAS 26061-35-8
Copper chlorophyll sodium
CAS 26061-35-8C34H30CuN4Na2O5
Methylchlorophyllide A chemical structure, C36H36MgN4O5, CAS 15741-04-5
Methylchlorophyllide A
CAS 15741-04-5C36H36MgN4O5
RefChem:579012 chemical structure, C55H72CuN4O5, CAS 15739-09-0
RefChem:579012
CAS 15739-09-0C55H72CuN4O5
Chlorophyll a' chemical structure, C55H72MgN4O5, CAS 22309-13-3
Chlorophyll a'
CAS 22309-13-3C55H72MgN4O5
Sodium (3S-(3alpha,4beta,21beta))-(14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-9-vinylphorbine-3-propionato(3-)-N23,N24,N25,N26)cuprate(1-) chemical structure, C35H35CuN4NaO5, CAS 84773-84-2
Sodium (3S-(3alpha,4beta,21beta))-(14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-9-vinylphorbine-3-propionato(3-)-N23,N24,N25,N26)cuprate(1-)
CAS 84773-84-2C35H35CuN4NaO5
Potassium, copper, 3-[(3R,21S,22S)-16-ethenyl-11-ethyl-12-formyl-4-hydroxy-3-methoxycarbonyl-17,21,26-trimethyl-23,24,25-triaza-7-azanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),4,8(26),9,11,13(25),14,16,18(24),19-undecaen-22-yl]propanoic acid chemical structure, C35H33CuKN4O6, CAS 84773-87-5
Potassium, copper, 3-[(3R,21S,22S)-16-ethenyl-11-ethyl-12-formyl-4-hydroxy-3-methoxycarbonyl-17,21,26-trimethyl-23,24,25-triaza-7-azanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),4,8(26),9,11,13(25),14,16,18(24),19-undecaen-22-yl]propanoic acid
CAS 84773-87-5C35H33CuKN4O6
Potassium (3S-(3alpha,4beta,21beta))-(14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-9-vinylphorbine-3-propionato(3-)-N23,N24,N25,N26)cuprate(1-) chemical structure, C35H35CuKN4O5, CAS 84773-85-3
Potassium (3S-(3alpha,4beta,21beta))-(14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-9-vinylphorbine-3-propionato(3-)-N23,N24,N25,N26)cuprate(1-)
CAS 84773-85-3C35H35CuKN4O5