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Murcko scaffold

Ring system with 3 rings and 14 atoms

45 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 14
Chemicals: 45
With full pages: 3

Scaffold SMILES

c1ccc2c(c1)OCC1CCCCC21

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 c1ccc2c(c1)OCC1CCCCC21

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 45 of 45 chemicals

3-(1,1-Dimethylheptyl)-6a,7,8,9,10,10a-hexahydro-6,6-dimethyl-6H-dibenzo(b,d)pyran-1,9-diol chemical structure, C24H38O3, CAS 56689-43-1

3-(1,1-Dimethylheptyl)-6a,7,8,9,10,10a-hexahydro-6,6-dimethyl-6H-dibenzo(b,d)pyran-1,9-diol

CAS 56689-43-1C₂₄H₃₈O₃

7-Hydroxyhexahydrocannabinol chemical structure, C21H32O3, CAS 64663-39-4

7-Hydroxyhexahydrocannabinol

CAS 64663-39-4C₂₁H₃₂O₃

Cannabiripsol chemical structure, C21H32O4, CAS 72236-32-9

CAS 72236-32-9C₂₁H₃₂O₄

1,2-Dihydroxyhexahydrocannabinol acetate chemical structure, C25H36O6, CAS 77369-37-0

1,2-Dihydroxyhexahydrocannabinol acetate

CAS 77369-37-0C₂₅H₃₆O₆

C(11)-Methyl-hexahydrocannabinol chemical structure, C21H32O2, CAS 6692-85-9

C(11)-Methyl-hexahydrocannabinol

CAS 6692-85-9C₂₁H₃₂O₂

6H-Dibenzo(b,d)pyran-1,9-diol, 6a,7,8,9,10,10a-hexahydro-6,6-dimethyl-3-(1,1-dimethylheptyl)-,(6a-alpha,9-alpha,10a-beta)- chemical structure, C24H38O3, CAS 101693-56-5

6H-Dibenzo(b,d)pyran-1,9-diol, 6a,7,8,9,10,10a-hexahydro-6,6-dimethyl-3-(1,1-dimethylheptyl)-,(6a-alpha,9-alpha,10a-beta)-

CAS 101693-56-5C₂₄H₃₈O₃

6H-Dibenzo(b,d)pyran-8-t-9-methanol, 3-(1,1-dimethylheptyl)-6a,7,8,9,10,10a-hexahydro-9-t-1-hydroxy-6,6-dimethyl-, (6aR-(6aalpha,8beta,9alpha,10abeta))- chemical structure, C25H40O3, CAS 140835-18-3

6H-Dibenzo(b,d)pyran-8-t-9-methanol, 3-(1,1-dimethylheptyl)-6a,7,8,9,10,10a-hexahydro-9-t-1-hydroxy-6,6-dimethyl-, (6aR-(6aalpha,8beta,9alpha,10abeta))-

CAS 140835-18-3C₂₅H₄₀O₃

HU-243 chemical structure, C25H40O3, CAS 140835-14-9

CAS 140835-14-9C₂₅H₄₀O₃

6a,7,8,9,10,10a-Hexahydro-6,6-dimethyl-3-pentyl-6H-dibenzo(b,d)pyran-1,9-diol chemical structure, C20H30O3, CAS 52171-85-4

6a,7,8,9,10,10a-Hexahydro-6,6-dimethyl-3-pentyl-6H-dibenzo(b,d)pyran-1,9-diol

CAS 52171-85-4C₂₀H₃₀O₃

AM-905 chemical structure, C23H34O3, CAS 181139-62-8

CAS 181139-62-8C₂₃H₃₄O₃

AM-906 chemical structure, C23H34O3, CAS 180989-26-8

CAS 180989-26-8C₂₃H₃₄O₃

AM-4030 chemical structure, C27H42O4, CAS 587023-54-9

CAS 587023-54-9C₂₇H₄₂O₄

AM-938 chemical structure, C27H40O4, CAS 303113-08-8

CAS 303113-08-8C₂₇H₄₀O₄

AM-919 chemical structure, C27H44O4, CAS 164228-46-0

CAS 164228-46-0C₂₇H₄₄O₄

9(R)-Hexahydrocannabinol chemical structure, C21H32O2, CAS 36403-90-4

9(R)-Hexahydrocannabinol

CAS 36403-90-4C₂₁H₃₂O₂

9(S)-Hexahydrocannabinol chemical structure, C21H32O2, CAS 36403-91-5

9(S)-Hexahydrocannabinol

CAS 36403-91-5C₂₁H₃₂O₂

Hexahydrocannabinol chemical structure, C21H32O2, CAS 946512-74-9

Hexahydrocannabinol

CAS 946512-74-9C₂₁H₃₂O₂

10AH-Dibenzo[B,D]pyran-10A-amine, 6,6A,7,8,9,10- chemical structure, C14H19NO, CAS 132453-23-7

10AH-Dibenzo[B,D]pyran-10A-amine, 6,6A,7,8,9,10-

CAS 132453-23-7C₁₄H₁₉NO

6H-Dibenzo(b,d)pyran-1,9-diol, 6a,7,8,9,10,10a-hexahydro-6,6-dimethyl-3-(4-ethoxy-1-methylbutyl)- chemical structure, C22H34O4, CAS 94339-41-0

6H-Dibenzo(b,d)pyran-1,9-diol, 6a,7,8,9,10,10a-hexahydro-6,6-dimethyl-3-(4-ethoxy-1-methylbutyl)-

CAS 94339-41-0C₂₂H₃₄O₄

6H-Dibenzo(b,d)pyran-1,9-diol, 6a,7,8,9,10,10a-hexahydro-6,6-dimethyl-3-(4-methoxy-1-methylbutyl)- chemical structure, C21H32O4, CAS 94339-35-2

6H-Dibenzo(b,d)pyran-1,9-diol, 6a,7,8,9,10,10a-hexahydro-6,6-dimethyl-3-(4-methoxy-1-methylbutyl)-

CAS 94339-35-2C₂₁H₃₂O₄

(±)-9-Nor-9beta-hydroxy hexahydrocannabinol chemical structure, C20H30O3, CAS 56469-25-1

(±)-9-Nor-9beta-hydroxy hexahydrocannabinol

CAS 56469-25-1C₂₀H₃₀O₃

11-Acetoxy-delta(8)-tetrahydrocannabinol chemical structure, C23H33O5-, CAS 36871-18-8

11-Acetoxy-delta(8)-tetrahydrocannabinol

CAS 36871-18-8C₂₃H₃₃O₅-

Canbisol, (±)-(rrs)- chemical structure, C24H38O3, CAS 56469-23-9

Canbisol, (±)-(rrs)-

CAS 56469-23-9C₂₄H₃₈O₃

(1'',2''-Dimethyl-5''-ethyl)-delta6-tetrahydrocannabinol chemical structure, C25H40O2, CAS 343770-62-7

(1'',2''-Dimethyl-5''-ethyl)-delta6-tetrahydrocannabinol

CAS 343770-62-7C₂₅H₄₀O₂