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Murcko scaffold

Ring system with 4 rings and 19 atoms

89 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
19
Chemicals
89
With full pages
40
Scaffold SMILES

O=C(Cc1ccccc1)OC1CC2NC(C1)C1OC21

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=C(Cc1ccccc1)OC1CC2NC(C1)C1OC21

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 48 of 89 chemicals

9-Methyl-9-oxido-3-oxa-9-azatricyclo[3.3.1.0~2,4~]non-7-yl 3-hydroxy-2-phenylpropanoate chemical structure, C17H21NO5, CAS 1219532-34-9
9-Methyl-9-oxido-3-oxa-9-azatricyclo[3.3.1.0~2,4~]non-7-yl 3-hydroxy-2-phenylpropanoate
CAS 1219532-34-9C17H21NO5
9-Methyl-3-oxa-9-azatricyclo(3.3.1.02,4)nonan-7-yl tropate chemical structure, C17H21NO4, CAS 475199-31-6
9-Methyl-3-oxa-9-azatricyclo(3.3.1.02,4)nonan-7-yl tropate
CAS 475199-31-6C17H21NO4
N-Methylscopolamine chemical structure, C18H24NO4+, CAS 13265-10-6
N-Methylscopolamine
CAS 13265-10-6C18H24NO4+
Norhyoscine chemical structure, C16H19NO4, CAS 4684-28-0
Norhyoscine
CAS 4684-28-0C16H19NO4
Npc172518 chemical structure, C17H21NO4
Npc172518
C17H21NO4
5-Ethyl-5-phenyl-1,3-diazinane-2,4,6-trione, bis([(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (2S)-3-hydroxy-2-phenylpropanoate), (9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl) 3-hydroxy-2-phenylpropanoate, sulfuric acid, hydrobromide chemical structure, C63H84BrN5O21S2
5-Ethyl-5-phenyl-1,3-diazinane-2,4,6-trione, bis([(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (2S)-3-hydroxy-2-phenylpropanoate), (9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl) 3-hydroxy-2-phenylpropanoate, sulfuric acid, hydrobromide
C63H84BrN5O21S2
Butylscopolamine chemical structure, C21H30NO4+, CAS 7182-53-8
Butylscopolamine
CAS 7182-53-8C21H30NO4+
(-)-3alpha-(2,3-Dihydroxy-2-phenylpropionyloxy)-6,7-epoxytropane chemical structure, C17H21NO5, CAS 58072-37-0
(-)-3alpha-(2,3-Dihydroxy-2-phenylpropionyloxy)-6,7-epoxytropane
CAS 58072-37-0C17H21NO5
Tranquo-buscopan chemical structure, C36H41BrClN3O6, CAS 78940-00-8
Tranquo-buscopan
CAS 78940-00-8C36H41BrClN3O6
RefChem:1074953 chemical structure, C34H46BrN4NaO8S, CAS 8059-83-4
RefChem:1074953
CAS 8059-83-4C34H46BrN4NaO8S
n-Methylscopolamine methylsulfate chemical structure, C19H27NO8S, CAS 18067-13-5
n-Methylscopolamine methylsulfate
CAS 18067-13-5C19H27NO8S
Npc234378 chemical structure, C17H21NO4
Npc234378
C17H21NO4
Tropan-3-ol, 6,7-epoxy-, tropate (ester), hydrobromide chemical structure, C17H22BrNO4, CAS 20368-51-8
Tropan-3-ol, 6,7-epoxy-, tropate (ester), hydrobromide
CAS 20368-51-8C17H22BrNO4
9-Methyl-9-oxido-3-oxa-9-azatricyclo(3.3.1.02,4)nonan-7-yl tropate hydrobromide (1:1) chemical structure, C17H22BrNO5, CAS 1219375-42-4
9-Methyl-9-oxido-3-oxa-9-azatricyclo(3.3.1.02,4)nonan-7-yl tropate hydrobromide (1:1)
CAS 1219375-42-4C17H22BrNO5
Scopolamine hydrobromide hydrate chemical structure, C17H28BrNO7
Scopolamine hydrobromide hydrate
C17H28BrNO7
Methscopolamine nitrate chemical structure, C18H24N2O7, CAS 6106-46-3
Methscopolamine nitrate
CAS 6106-46-3C18H24N2O7
Npc248142 chemical structure, C17H21NO4, CAS 64069-63-2
Npc248142
CAS 64069-63-2C17H21NO4
Methyl5-(1-pyrrolidinyl)-2-pyrazinecarboxylate chemical structure, C17H28BrNO7
Methyl5-(1-pyrrolidinyl)-2-pyrazinecarboxylate
C17H28BrNO7
Boro-scopol chemical structure, C17H21NO4, CAS 51-34-3
Boro-scopol
CAS 51-34-3C17H21NO4
Scopolamine N-oxide chemical structure, C17H21NO5, CAS 97-75-6
Scopolamine N-oxide
CAS 97-75-6C17H21NO5
RefChem:1074296 chemical structure, C28H37N5O9S, CAS 52692-73-6
RefChem:1074296
CAS 52692-73-6C28H37N5O9S
RefChem:1074952 chemical structure, C31H43N5O9S, CAS 52692-74-7
RefChem:1074952
CAS 52692-74-7C31H43N5O9S
9-Methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]nonan-7-yl 3-hydroxy-2-phenylpropanoate--1-phenylpropan-2-amine (1/1) chemical structure, C26H34N2O4, CAS 74203-44-4
9-Methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]nonan-7-yl 3-hydroxy-2-phenylpropanoate--1-phenylpropan-2-amine (1/1)
CAS 74203-44-4C26H34N2O4
Npc190558 chemical structure, C17H21NO4
Npc190558
C17H21NO4