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Murcko scaffold

Ring system with 3 rings and 18 atoms

16 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
16
With full pages
3
Scaffold SMILES

O=C1c2ccc(=O)[nH]c2C(=O)c2[nH]c(=O)ccc21

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=C1c2ccc(=O)[nH]c2C(=O)c2[nH]c(=O)ccc21

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 16 of 16 chemicals

Diazaquinomycin A chemical structure, C20H22N2O4, CAS 87614-40-2
Diazaquinomycin A
CAS 87614-40-2C20H22N2O4
Deoxynyboquinone chemical structure, C15H12N2O4, CAS 96748-86-6
Deoxynyboquinone
CAS 96748-86-6C15H12N2O4
Sch 538415 chemical structure, C16H14N2O4, CAS 637772-75-9
Sch 538415
CAS 637772-75-9C16H14N2O4
2-[[3-(2,2-Dicarboxyethyl)-2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinolin-7-yl]methyl]propanedioic acid chemical structure, C26H26N2O12, CAS 119623-79-9
2-[[3-(2,2-Dicarboxyethyl)-2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinolin-7-yl]methyl]propanedioic acid
CAS 119623-79-9C26H26N2O12
3-[3-(2-Carboxyethyl)-2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinolin-7-yl]propanoic acid chemical structure, C24H26N2O8, CAS 119623-82-4
3-[3-(2-Carboxyethyl)-2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinolin-7-yl]propanoic acid
CAS 119623-82-4C24H26N2O8
1,2,5,8,9,10-Hexahydro-2,5,8,10-tetraoxo-4,6-dipropylpyrido[3,2-g]quinoline-3,7-dicarboxylic acid chemical structure, C20H18N2O8, CAS 119623-84-6
1,2,5,8,9,10-Hexahydro-2,5,8,10-tetraoxo-4,6-dipropylpyrido[3,2-g]quinoline-3,7-dicarboxylic acid
CAS 119623-84-6C20H18N2O8
Ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinolin-7-yl]acetate chemical structure, C26H30N2O8, CAS 119623-87-9
Ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinolin-7-yl]acetate
CAS 119623-87-9C26H30N2O8
Diethyl 2-[[3-(3-ethoxy-2-ethoxycarbonyl-3-oxopropyl)-2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinolin-7-yl]methyl]propanedioate chemical structure, C34H42N2O12, CAS 119623-89-1
Diethyl 2-[[3-(3-ethoxy-2-ethoxycarbonyl-3-oxopropyl)-2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinolin-7-yl]methyl]propanedioate
CAS 119623-89-1C34H42N2O12
Ethyl 3-[3-(3-ethoxy-3-oxopropyl)-2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinolin-7-yl]propanoate chemical structure, C28H34N2O8, CAS 119623-90-4
Ethyl 3-[3-(3-ethoxy-3-oxopropyl)-2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinolin-7-yl]propanoate
CAS 119623-90-4C28H34N2O8
Diethyl 2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinoline-3,7-dicarboxylate chemical structure, C24H26N2O8, CAS 119623-91-5
Diethyl 2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinoline-3,7-dicarboxylate
CAS 119623-91-5C24H26N2O8
3,7-Bis(ethoxymethyl)-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone chemical structure, C24H30N2O6, CAS 119623-96-0
3,7-Bis(ethoxymethyl)-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone
CAS 119623-96-0C24H30N2O6
3-(Ethoxymethyl)-7-methyl-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone chemical structure, C22H26N2O5, CAS 119623-97-1
3-(Ethoxymethyl)-7-methyl-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone
CAS 119623-97-1C22H26N2O5
(7-Methyl-2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinolin-3-yl)methyl acetate chemical structure, C22H24N2O6, CAS 119623-95-9
(7-Methyl-2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinolin-3-yl)methyl acetate
CAS 119623-95-9C22H24N2O6
[3-(Acetyloxymethyl)-2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinolin-7-yl]methyl acetate chemical structure, C24H26N2O8, CAS 119623-93-7
[3-(Acetyloxymethyl)-2,5,8,10-tetraoxo-4,6-dipropyl-1,9-dihydropyrido[3,2-g]quinolin-7-yl]methyl acetate
CAS 119623-93-7C24H26N2O8
Isobutyl-deoxynyboquinone chemical structure, C18H18N2O4, CAS 1430798-22-3
Isobutyl-deoxynyboquinone
CAS 1430798-22-3C18H18N2O4
4,6-Dimethyl-1-(3-methylbutyl)-9H-pyrido[3,2-g]quinoline-2,5,8,10-tetrone chemical structure, C19H20N2O4, CAS 1430798-23-4
4,6-Dimethyl-1-(3-methylbutyl)-9H-pyrido[3,2-g]quinoline-2,5,8,10-tetrone
CAS 1430798-23-4C19H20N2O4