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Murcko scaffold

Ring system with 5 rings and 25 atoms

11 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
25
Chemicals
11
With full pages
3
Scaffold SMILES

c1ccc2c(c1)CCN=C2CC1CCN2CCc3ccccc3C2C1

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)CCN=C2CC1CCN2CCc3ccccc3C2C1

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

Methylpsychotrine chemical structure, C29H38N2O4, CAS 523-01-3
Methylpsychotrine
CAS 523-01-3C29H38N2O4
Psychotrine dihydrogen oxalate chemical structure, C30H38N2O8, CAS 30959-09-2
Psychotrine dihydrogen oxalate
CAS 30959-09-2C30H38N2O8
Psychotrine chemical structure, C28H36N2O4, CAS 7633-29-6
Psychotrine
CAS 7633-29-6C28H36N2O4
Alangicine chemical structure, C28H36N2O5, CAS 16531-04-7
Alangicine
CAS 16531-04-7C28H36N2O5
16,17-Dinoremetan, 1',2'-didehydro-1-methyl-6',7',10,11-tetramethoxy-, dihydrochloride, (1-alpha,2-alpha)-(+-)- chemical structure, C28H38Cl2N2O4, CAS 65061-34-9
16,17-Dinoremetan, 1',2'-didehydro-1-methyl-6',7',10,11-tetramethoxy-, dihydrochloride, (1-alpha,2-alpha)-(+-)-
CAS 65061-34-9C28H38Cl2N2O4
16,17-Dinoremetan, 1',2'-didehydro-1-methyl-6',7',10,11-tetramethoxy-, dihydrochloride, (1-alpha)-(+-)- chemical structure, C28H38Cl2N2O4, CAS 65085-32-7
16,17-Dinoremetan, 1',2'-didehydro-1-methyl-6',7',10,11-tetramethoxy-, dihydrochloride, (1-alpha)-(+-)-
CAS 65085-32-7C28H38Cl2N2O4
16,17-Dinoremetan, 1',2'-didehydro-1-methyl-6',7',10,11-tetramethoxy-, dihydrochloride, (1-beta)-(+-)- chemical structure, C28H38Cl2N2O4, CAS 65085-33-8
16,17-Dinoremetan, 1',2'-didehydro-1-methyl-6',7',10,11-tetramethoxy-, dihydrochloride, (1-beta)-(+-)-
CAS 65085-33-8C28H38Cl2N2O4
O-Methylpsychotrine oxylate chemical structure, C31H40N2O8, CAS 14637-07-1
O-Methylpsychotrine oxylate
CAS 14637-07-1C31H40N2O8
Psychotrine sulfate trihydrate chemical structure, C28H44N2O11S, CAS 6164-91-6
Psychotrine sulfate trihydrate
CAS 6164-91-6C28H44N2O11S
Psychotrine tetrahydrate chemical structure, C28H44N2O8, CAS 6199-09-3
Psychotrine tetrahydrate
CAS 6199-09-3C28H44N2O8
Psychotrine sulfate chemical structure, C28H38N2O8S, CAS 49723-56-0
Psychotrine sulfate
CAS 49723-56-0C28H38N2O8S