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Murcko scaffold

Ring system with 7 rings and 33 atoms

30 chemicals on CompoundList share this ring system.

Rings
7
Scaffold atoms
33
Chemicals
30
With full pages
4
Scaffold SMILES

c1ccc(C2CCc3ccc4c(c3O2)C2CC(c3ccccc3)(Oc3ccccc32)O4)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 c1ccc(C2CCc3ccc4c(c3O2)C2CC(c3ccccc3)(Oc3ccccc32)O4)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 30 of 30 chemicals

Procyanidin A2 chemical structure, C30H24O12, CAS 41743-41-3
Procyanidin A2
CAS 41743-41-3C30H24O12
8,14-Methano-2H,14H-1-benzopyrano(7,8-d)(1,3)benzodioxocin-3,5,11,13,15-pentol, 3,4-dihydro-2,8-bis(4-hydroxyphenyl)-, (2R,3R,8R,14S,15S)- chemical structure, C30H24O10, CAS 82765-89-7
8,14-Methano-2H,14H-1-benzopyrano(7,8-d)(1,3)benzodioxocin-3,5,11,13,15-pentol, 3,4-dihydro-2,8-bis(4-hydroxyphenyl)-, (2R,3R,8R,14S,15S)-
CAS 82765-89-7C30H24O10
Dracoflavan B1 chemical structure, C33H30O7, CAS 194794-44-0
Dracoflavan B1
CAS 194794-44-0C33H30O7
Dracoflavan B2 chemical structure, C33H30O7, CAS 194794-47-3
Dracoflavan B2
CAS 194794-47-3C33H30O7
Dracoflavan C2 chemical structure, C33H30O6, CAS 194794-50-8
Dracoflavan C2
CAS 194794-50-8C33H30O6
Dracoflavan D1 chemical structure, C32H28O6, CAS 194794-51-9
Dracoflavan D1
CAS 194794-51-9C32H28O6
Dracoflavan D2 chemical structure, C32H28O6, CAS 194794-53-1
Dracoflavan D2
CAS 194794-53-1C32H28O6
Dracoflavan C1 chemical structure, C33H30O6, CAS 194794-49-5
Dracoflavan C1
CAS 194794-49-5C33H30O6
ent-Apigeniflavan-(2alpha->7,4alpha->8)-epiafzelechin chemical structure, C30H24O9, CAS 88010-42-8
ent-Apigeniflavan-(2alpha->7,4alpha->8)-epiafzelechin
CAS 88010-42-8C30H24O9
Procyanidin A1 chemical structure, C30H24O12, CAS 12798-56-0
Procyanidin A1
CAS 12798-56-0C30H24O12
Proanthocyanidin A1 chemical structure, C30H24O12, CAS 103883-03-0
Proanthocyanidin A1
CAS 103883-03-0C30H24O12
Proanthocyanidin A5' chemical structure, C30H24O12, CAS 111466-30-9
Proanthocyanidin A5'
CAS 111466-30-9C30H24O12
(1S,5S,13S)-9,19-Dimethoxy-18-methyl-5,13-diphenyl-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2,8,10,15(20),16,18-hexaen-17-ol chemical structure, C33H30O6
(1S,5S,13S)-9,19-Dimethoxy-18-methyl-5,13-diphenyl-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2,8,10,15(20),16,18-hexaen-17-ol
C33H30O6
(1R,5S,13R)-9,19-Dimethoxy-18-methyl-5,13-diphenyl-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2,8,10,15(20),16,18-hexaen-17-ol chemical structure, C33H30O6
(1R,5S,13R)-9,19-Dimethoxy-18-methyl-5,13-diphenyl-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2,8,10,15(20),16,18-hexaen-17-ol
C33H30O6
Mahuannin B chemical structure, C30H24O10, CAS 82796-37-0
Mahuannin B
CAS 82796-37-0C30H24O10
Prodelphinidin A1 chemical structure, C30H24O14, CAS 307504-23-0
Prodelphinidin A1
CAS 307504-23-0C30H24O14
Geranin A chemical structure, C30H24O10, CAS 226715-59-9
Geranin A
CAS 226715-59-9C30H24O10
Epiafzelechin-(2beta-O->7,4beta->8)-ent-epicatechin chemical structure, C30H24O11, CAS 135820-73-4
Epiafzelechin-(2beta-O->7,4beta->8)-ent-epicatechin
CAS 135820-73-4C30H24O11
9,19-Dimethoxy-18-methyl-5,13-diphenyl-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2,8,10,15(20),16,18-hexaene-17,21-diol chemical structure, C33H30O7
9,19-Dimethoxy-18-methyl-5,13-diphenyl-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2,8,10,15(20),16,18-hexaene-17,21-diol
C33H30O7
9,19-Dimethoxy-18-methyl-5,13-diphenyl-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2,8,10,15(20),16,18-hexaen-17-ol chemical structure, C33H30O6
9,19-Dimethoxy-18-methyl-5,13-diphenyl-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2,8,10,15(20),16,18-hexaen-17-ol
C33H30O6
(1R,5S,13S)-9,19-Dimethoxy-18-methyl-5,13-diphenyl-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2,8,10,15(20),16,18-hexaene-17,21-diol chemical structure, C33H30O7
(1R,5S,13S)-9,19-Dimethoxy-18-methyl-5,13-diphenyl-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2,8,10,15(20),16,18-hexaene-17,21-diol
C33H30O7
RefChem:311535 chemical structure, C30H24O11, CAS 148843-32-7
RefChem:311535
CAS 148843-32-7C30H24O11
Orb1219163 chemical structure, C30H24O12
Orb1219163
C30H24O12
(1R,5R,6S,13S)-5,13-Bis(3,4-dihydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol chemical structure, C30H24O12
(1R,5R,6S,13S)-5,13-Bis(3,4-dihydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol
C30H24O12