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Murcko scaffold

Ring system with 3 rings and 14 atoms

12 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
14
Chemicals
12
With full pages
2
Scaffold SMILES

C1=CCC2C(=C1)CCC1CCCCC12

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=CCC2C(=C1)CCC1CCCCC12

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 12 of 12 chemicals

Levopimaric acid chemical structure, C20H30O2, CAS 79-54-9
Levopimaric acid
CAS 79-54-9C20H30O2
Pimaric acid (L) chemical structure, C24H41NO3, CAS 6980-90-1
Pimaric acid (L)
CAS 6980-90-1C24H41NO3
1-Isocyanato-1,4a-dimethyl-7-(propan-2-yl)-1,2,3,4,4a,4b,5,9,10,10a-decahydrophenanthrene chemical structure, C20H29NO, CAS 6636-96-0
1-Isocyanato-1,4a-dimethyl-7-(propan-2-yl)-1,2,3,4,4a,4b,5,9,10,10a-decahydrophenanthrene
CAS 6636-96-0C20H29NO
(4aS,4bS,10aS)-1,2,3,4,4a,4b,5,9,10,10a-Decahydro-1,1,4a-trimethyl-7-(1-methylethyl)phenanthrene chemical structure, C20H32, CAS 122712-77-0
(4aS,4bS,10aS)-1,2,3,4,4a,4b,5,9,10,10a-Decahydro-1,1,4a-trimethyl-7-(1-methylethyl)phenanthrene
CAS 122712-77-0C20H32
Levopimaradienol chemical structure, C20H32O, CAS 97640-46-5
Levopimaradienol
CAS 97640-46-5C20H32O
Levopimaradienal chemical structure, C20H30O, CAS 103654-28-0
Levopimaradienal
CAS 103654-28-0C20H30O
Methyl levopimarate chemical structure, C21H32O2, CAS 3513-69-7
Methyl levopimarate
CAS 3513-69-7C21H32O2
Ethyl (1R,4aR,4bS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,9,10,10a-octahydrophenanthrene-1-carboxylate chemical structure, C22H34O2, CAS 57274-59-6
Ethyl (1R,4aR,4bS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,9,10,10a-octahydrophenanthrene-1-carboxylate
CAS 57274-59-6C22H34O2
Sodium (1R-(1alpha,4abeta,4balpha,10aalpha))-1,2,3,4,4a,4b,5,9,10,10a-decahydro-7-isopropyl-1,4a-dimethylphenanthren-1-carboxylate chemical structure, C20H29NaO2, CAS 51590-83-1
Sodium (1R-(1alpha,4abeta,4balpha,10aalpha))-1,2,3,4,4a,4b,5,9,10,10a-decahydro-7-isopropyl-1,4a-dimethylphenanthren-1-carboxylate
CAS 51590-83-1C20H29NaO2
Potassium (1R-(1alpha,4abeta,4balpha,10aalpha))-1,2,3,4,4a,4b,5,9,10,10a-decahydro-7-isopropyl-1,4a-dimethylphenanthren-1-carboxylate chemical structure, C20H29KO2, CAS 93839-79-3
Potassium (1R-(1alpha,4abeta,4balpha,10aalpha))-1,2,3,4,4a,4b,5,9,10,10a-decahydro-7-isopropyl-1,4a-dimethylphenanthren-1-carboxylate
CAS 93839-79-3C20H29KO2
Monolevopimaric acid 1-glyceryl ester chemical structure, C23H36O4, CAS 1700652-01-2
Monolevopimaric acid 1-glyceryl ester
CAS 1700652-01-2C23H36O4
Levopimaric Acid 2-Amino-2-methyl-1-propanol chemical structure, C24H41NO3
Levopimaric Acid 2-Amino-2-methyl-1-propanol
C24H41NO3