Murcko scaffold
Ring system with 3 rings and 18 atoms
235 chemicals on CompoundList share this ring system.
- Rings
- 3
- Scaffold atoms
- 18
- Chemicals
- 235
- With full pages
- 57
Scaffold SMILES
O=C(Cc1ccccc1)OC1CC2CCC(C1)N2
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.
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 235 chemicals
(6-Hydroxy-8-methyl-8-azabicyclo(3.2.1)octan-3-yl) 3-hydroxy-2-phenylpropanoate
CAS 17659-49-3C17H23NO4
(8-Methyl-8-azabicyclo(3.2.1)octan-3-yl) 2-hydroxy-2-phenylacetate
CAS 114173-36-3C16H21NO3
(8-Methyl-8-azabicyclo(3.2.1)octan-3-yl) 3-hydroxy-2-phenylpropanoate
CAS 83454-31-3C17H23NO3
3-(3-Hydroxy-1-oxo-2-phenylpropoxy)-8,8-dimethyl-8-azoniabicyclo(3.2.1)octane
CAS 6912-76-1C18H26NO3+
Atropine sulphate
CAS 1263045-48-2C34H48N2O10S
Homatropine methylbromide
CAS 80-49-9C17H24BrNO3
Atropine methylbromide
CAS 4662-16-2C18H26BrNO3
Atropine octabromide
CAS 5843-82-3C25H40BrNO3
Ipratropii bromidum
CAS 2784-21-6C20H30BrNO3
Duboisene
C17H24ClNO3
Atropine, sulfate (2:1), dihydrate
CAS 73791-47-6C34H52N2O12S
Mandelic acid, alpha-(1-propynyl)-, 3-alpha-tropanyl ester
CAS 92956-07-5C19H23NO3
Mandelic acid, alpha-(1-butynyl)-, 3-alpha-tropanyl ester
CAS 101756-52-9C20H25NO3
![(8,8-Dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-phenylpropanoate iodide chemical structure, C18H26INO3](/s/CVWRJQHABQDGRP-UHFFFAOYSA-M.svg)
(8,8-Dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-phenylpropanoate iodide
C18H26INO3
Atropine nitrate
CAS 7459-97-4C17H24N2O6
Atropine O-(hydrogen sulphate)
CAS 5226-98-2C17H23NO6S
Atropine salicylate
CAS 5908-95-2C24H29NO6
![(8-Methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-phenylpropanoate, sulfuric acid, hydrate chemical structure, C34H50N2O11S](/s/JPKKQJKQTPNWTR-UHFFFAOYSA-N.svg)
(8-Methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-phenylpropanoate, sulfuric acid, hydrate
C34H50N2O11S
(-)-Tropic Acid Ester with Tropine
C34H48N2O10S
Levomepate hydrochloride
CAS 14641-96-4C18H26ClNO3
![3-Bicyclo[3.2.1]octanyl 3-hydroxy-2-phenyl-propanoate chemical structure, C17H23NO4, CAS 39459-41-1](/s/WTQYWNWRJNXDEG-BJWPUDQFSA-N.svg)
3-Bicyclo[3.2.1]octanyl 3-hydroxy-2-phenyl-propanoate
CAS 39459-41-1C17H23NO4
![(8-Methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-methyl-2-phenylpropanoate chemical structure, C18H25NO3](/s/XZPAMMPYTOAFOU-UHFFFAOYSA-N.svg)
(8-Methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-methyl-2-phenylpropanoate
C18H25NO3
Benzeneacetic acid, 3-fluoro-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester
CAS 16048-45-6C16H20FNO2
Tropic acid, 4'-bromo-, 3-tropanyl ester
CAS 63978-22-3C17H22BrNO3
- Tropic acid, 4'-methoxy-, 3-tropanyl ester63978-25-6C18H25NO4
- 3-Tropanyl 4'-methyltropate63978-26-7C18H25NO3
- Tropine 4-tolylacetate1690-20-6C17H23NO2
- N-Methyltropan-3-yl 2-(4-bromophenyl)propionate156143-26-9C17H22BrNO2
- 4-Azidoatropine methiodide90991-00-7C18H25N4O3+
- 5 suppliersBenzeneacetic acid, alpha-(hydroxymethyl)-, (3-endo)-8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, (alphaS)-101-31-5C17H23NO3
- 64 suppliersNpc20977351-55-8C17H23NO3
- 1 suppliersOxymethylatropine2515-36-8C18H25NO4
- 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, o-fluorophenylacetate, hydrochloride2532-86-7C16H20FNO2
- 1 suppliersPhenylacetoxytropane1690-22-8C16H21NO2
- 8-(Prop-2-YN-1-yl)-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-phenylpropanoateC19H23NO3
- Di-n-propylacetyl-homatropine [French]29135-16-8C24H35NO4
- (8-Methyl-8-oxido-8-azoniabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2-phenylacetate7174-29-0C16H21NO4
- Hydroxy-phenyl-acetic acid 8-methyl-8-aza-bicyclo(3.2.1)oct-3-yl ester51017-33-5C16H21NO3
- 15 suppliers((1S,5R)-8-Methyl-8-azabicyclo(3.2.1)octan-3-yl) (2R)-3-hydroxy-2-phenylpropanoate13269-35-7C17H23NO3
- Methylatropine31610-87-4C18H26NO3+
- (3-Endo)-3-[(2S)-3-hydroxy-1-oxo-2-phenylpropoxy]-8,8-dimethyl-8-azoniabicyclo[3.2.1]octane68686-62-4C18H26NO3+
- 5 suppliersIpratropium60205-81-4C20H30NO3+
- (-)-Homatropine51017-31-3C16H21NO3
- Homatropine-methylbromide99571-70-7C17H24NO3+
- [(1S,3R,5S,6R)-6-Hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (2S)-3-hydroxy-2-phenylpropanoate126371-43-5C17H23NO4
- (1R,3S,5R,6S)-6-Hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl (R)-3-hydroxy-2-phenylpropanoate76831-52-2C17H23NO4
- (3(R)-endo)-3-(3-Hydroxy-1-oxo-2-phenylpropoxy)-8,8-dimethyl-8-azoniabicyclo(3.2.1)octane57-69-2C18H26NO3+
- Mandelic acid, alpha-cyano-, 1-alpha-H,5-alpha-H-tropan-3-alpha-ylester, alpha-acetate, hydrochloride101756-53-0C19H23ClN2O4
Related scaffolds
Same ring framework with different atoms or bond orders
