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Murcko scaffold

Ring system with 4 rings and 25 atoms

40 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
25
Chemicals
40
With full pages
15
Scaffold SMILES

O=C(OC1Cc2ccccc2OC1c1ccccc1)c1ccccc1

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=C(OC1Cc2ccccc2OC1c1ccccc1)c1ccccc1

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 40 of 40 chemicals

Tea, ext. chemical structure, C22H18O11, CAS 84650-60-2
Tea, ext.
CAS 84650-60-2C22H18O11
Epigallocatechin gallate chemical structure, C22H18O11, CAS 989-51-5
Epigallocatechin gallate
CAS 989-51-5C22H18O11
Epicatechin gallate chemical structure, C22H18O10, CAS 1257-08-5
Epicatechin gallate
CAS 1257-08-5C22H18O10
2H-1-Benzopyran-3,5,7-triol, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-,3-benzoate, (2R-trans)- chemical structure, C22H18O7, CAS 71634-84-9
2H-1-Benzopyran-3,5,7-triol, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-,3-benzoate, (2R-trans)-
CAS 71634-84-9C22H18O7
Benzoic acid, 4-fluoro-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2R-trans)- chemical structure, C22H17FO7, CAS 71634-85-0
Benzoic acid, 4-fluoro-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2R-trans)-
CAS 71634-85-0C22H17FO7
Benzoic acid, 3,4-dihydroxy-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2R-trans)- chemical structure, C22H18O9, CAS 71634-86-1
Benzoic acid, 3,4-dihydroxy-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2R-trans)-
CAS 71634-86-1C22H18O9
1,2-Benzenedicarboxylic acid, mono(2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl) ester, (2R-trans)- chemical structure, C23H18O9, CAS 71634-88-3
1,2-Benzenedicarboxylic acid, mono(2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl) ester, (2R-trans)-
CAS 71634-88-3C23H18O9
Benzoic acid, 2-(acetyloxy)-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2R-trans)- chemical structure, C24H20O9, CAS 80500-87-4
Benzoic acid, 2-(acetyloxy)-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2R-trans)-
CAS 80500-87-4C24H20O9
(-)-Gallocatechin gallate chemical structure, C22H18O11, CAS 4233-96-9
(-)-Gallocatechin gallate
CAS 4233-96-9C22H18O11
Epigallocatechin-3-O-(4-O-methyl)gallate chemical structure, C23H20O11, CAS 224434-07-5
Epigallocatechin-3-O-(4-O-methyl)gallate
CAS 224434-07-5C23H20O11
Epiafzelechin 3-O-gallate chemical structure, C22H18O9, CAS 108907-43-3
Epiafzelechin 3-O-gallate
CAS 108907-43-3C22H18O9
Epicatechin 3-O-(3-O-methylgallate) chemical structure, C23H20O10, CAS 83104-86-3
Epicatechin 3-O-(3-O-methylgallate)
CAS 83104-86-3C23H20O10
Epicatechin 3-O-(4-O-methylgallate) chemical structure, C23H20O10, CAS 108907-44-4
Epicatechin 3-O-(4-O-methylgallate)
CAS 108907-44-4C23H20O10
cis-5,7-Dihydroxy-2-(3,4,5-trihydroxyphenyl)chroman-3-yl 3,4,5-trihydroxybenzoate chemical structure, C22H18O11, CAS 188819-08-1
cis-5,7-Dihydroxy-2-(3,4,5-trihydroxyphenyl)chroman-3-yl 3,4,5-trihydroxybenzoate
CAS 188819-08-1C22H18O11
(+)-Catechin 3-gallate chemical structure, C22H18O10, CAS 25615-05-8
(+)-Catechin 3-gallate
CAS 25615-05-8C22H18O10
Gallocatechin gallate chemical structure, C22H18O11, CAS 5127-64-0
Gallocatechin gallate
CAS 5127-64-0C22H18O11
(-)-Catechin gallate chemical structure, C22H18O10, CAS 130405-40-2
(-)-Catechin gallate
CAS 130405-40-2C22H18O10
Epigallocatechin 3-O-(3-O-methyl)gallate chemical structure, C23H20O11, CAS 83104-87-4
Epigallocatechin 3-O-(3-O-methyl)gallate
CAS 83104-87-4C23H20O11
Epigallocatechin 3-O-(3,5-di-O-methylgallate) chemical structure, C24H22O11, CAS 173484-92-9
Epigallocatechin 3-O-(3,5-di-O-methylgallate)
CAS 173484-92-9C24H22O11
(2R,3R)-5,7-Dihydroxy-6,8-bis((octylthio)methyl)-2-(3,4,5-trihydroxyphenyl)chroman-3-yl 3,4,5-trihydroxybenzoate chemical structure, C40H54O11S2, CAS 212633-21-1
(2R,3R)-5,7-Dihydroxy-6,8-bis((octylthio)methyl)-2-(3,4,5-trihydroxyphenyl)chroman-3-yl 3,4,5-trihydroxybenzoate
CAS 212633-21-1C40H54O11S2
[(2R,3R)-5,7-Dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate chemical structure, C24H22O11, CAS 765956-00-1
[(2R,3R)-5,7-Dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
CAS 765956-00-1C24H22O11
Epicatechin 3-O-p-hydroxybenzoate chemical structure, C22H18O8, CAS 108907-45-5
Epicatechin 3-O-p-hydroxybenzoate
CAS 108907-45-5C22H18O8
[2-(3,5-Dihydroxy-4-methoxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate chemical structure, C23H20O11
[2-(3,5-Dihydroxy-4-methoxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
C23H20O11
(2R,3R)-5,7-Diacetoxy-2-(3,4,5-triacetoxyphenyl)-3,4-dihydro-2H-chromen-3-yl 3,4,5-triacetoxybenzoate chemical structure, C38H34O19, CAS 148707-39-5
(2R,3R)-5,7-Diacetoxy-2-(3,4,5-triacetoxyphenyl)-3,4-dihydro-2H-chromen-3-yl 3,4,5-triacetoxybenzoate
CAS 148707-39-5C38H34O19