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Murcko scaffold

Ring system with 6 rings and 30 atoms

11 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
30
Chemicals
11
With full pages
6
Scaffold SMILES

O=C1CCCC2Oc3ccc(-c4ccc5c(c4)C=C4C(=O)CCCC4O5)cc3C=C12

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=C1CCCC2Oc3ccc(-c4ccc5c(c4)C=C4C(=O)CCCC4O5)cc3C=C12

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 11 of 11 chemicals

Secalonic acid D chemical structure, C32H30O14, CAS 35287-69-5
Secalonic acid D
CAS 35287-69-5C32H30O14
Npc79529 chemical structure, C32H30O14, CAS 35287-72-0
Npc79529
CAS 35287-72-0C32H30O14
Dimethyl 1,1',5,5',9,9'-hexahydroxy-6,6'-dimethyl-8,8'-dioxo-5,5',6,6',7,7',8,8'-octahydro-10aH,10'aH-(2,2'-bixanthene)-10a,10'a-dicarboxylate chemical structure, C32H30O14, CAS 35287-71-9
Dimethyl 1,1',5,5',9,9'-hexahydroxy-6,6'-dimethyl-8,8'-dioxo-5,5',6,6',7,7',8,8'-octahydro-10aH,10'aH-(2,2'-bixanthene)-10a,10'a-dicarboxylate
CAS 35287-71-9C32H30O14
Secalonic acid F chemical structure, C32H30O14
Secalonic acid F
C32H30O14
Secalonsaure D chemical structure, C32H30O14, CAS 60687-07-2
Secalonsaure D
CAS 60687-07-2C32H30O14
Secalonic acid E chemical structure, C32H30O14, CAS 51152-25-1
Secalonic acid E
CAS 51152-25-1C32H30O14
Secalonic acid G chemical structure, C32H30O14, CAS 70223-89-1
Secalonic acid G
CAS 70223-89-1C32H30O14
Dicerandrol C chemical structure, C38H38O16, CAS 361445-55-8
Dicerandrol C
CAS 361445-55-8C38H38O16
Secalonic acid C chemical structure, C32H30O14, CAS 35287-70-8
Secalonic acid C
CAS 35287-70-8C32H30O14
Rugulotrosin A chemical structure, C32H30O14, CAS 685135-81-3
Rugulotrosin A
CAS 685135-81-3C32H30O14
[2,2a(2)-Bixanthene]-10a(2)a,10a(5H,5a(2)H)-dicarboxylic acid, 6,6a(2),7,7a(2),8,8a(2)-hexahydro-1,1a(2),5,5a(2),9,9a(2)-hexahydroxy-6,6a(2)-dimethyl-8,8a(2)-dioxo-, 10a(2)a,10a-dioctyl ester, (5S,5a(2)S,6R,6a(2)R)- chemical structure, C46H58O14, CAS 959370-97-9
[2,2a(2)-Bixanthene]-10a(2)a,10a(5H,5a(2)H)-dicarboxylic acid, 6,6a(2),7,7a(2),8,8a(2)-hexahydro-1,1a(2),5,5a(2),9,9a(2)-hexahydroxy-6,6a(2)-dimethyl-8,8a(2)-dioxo-, 10a(2)a,10a-dioctyl ester, (5S,5a(2)S,6R,6a(2)R)-
CAS 959370-97-9C46H58O14