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Murcko scaffold

Ring system with 2 rings and 21 atoms

14 chemicals on CompoundList share this ring system.

Rings: 2
Scaffold atoms: 21
Chemicals: 14
With full pages: 3

Scaffold SMILES

C=C1CCCC(=O)OCC2=CCNCCC(OC1=O)C2=O

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 C=C1CCCC(=O)OCC2=CCNCCC(OC1=O)C2=O

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 14 of 14 chemicals

4-Ethylidene-7-hydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo(9.5.1)heptadec-11-ene-3,8,17-trione chemical structure, C19H27NO6, CAS 60827-69-2

4-Ethylidene-7-hydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo(9.5.1)heptadec-11-ene-3,8,17-trione

CAS 60827-69-2C₁₉H₂₇NO₆

Senkirkine chemical structure, C19H27NO6, CAS 2318-18-5

CAS 2318-18-5C₁₉H₂₇NO₆

Crotaverrine chemical structure, C19H27NO6

C₁₉H₂₇NO₆

Acetylsenkirkine chemical structure, C21H29NO7, CAS 53092-44-7

Acetylsenkirkine

CAS 53092-44-7C₂₁H₂₉NO₇

Ligularidine chemical structure, C21H29NO7, CAS 60872-63-1

CAS 60872-63-1C₂₁H₂₉NO₇

Neoligularidine chemical structure, C21H29NO7, CAS 90364-91-3

Neoligularidine

CAS 90364-91-3C₂₁H₂₉NO₇

Acetylanonamine chemical structure, C21H29NO8, CAS 138079-62-6

Acetylanonamine

CAS 138079-62-6C₂₁H₂₉NO₈

Neosenkirkine chemical structure, C19H27NO6, CAS 57194-70-4

CAS 57194-70-4C₁₉H₂₇NO₆

(1R,4E,6R,7S,11Z)-4-Ethylidene-7-hydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione chemical structure, C19H27NO6

(1R,4E,6R,7S,11Z)-4-Ethylidene-7-hydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione

C₁₉H₂₇NO₆

Crotafoline chemical structure, C18H25NO6, CAS 38494-87-0

CAS 38494-87-0C₁₈H₂₅NO₆

Anonamine chemical structure, C19H27NO7, CAS 111566-66-6

CAS 111566-66-6C₁₉H₂₇NO₇

(1R,4E,6S,7S,11Z)-4-Ethylidene-7-hydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione chemical structure, C19H27NO6

(1R,4E,6S,7S,11Z)-4-Ethylidene-7-hydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione

C₁₉H₂₇NO₆

4-Ethylidene-7-hydroxy-6,14-dimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione chemical structure, C18H25NO6

4-Ethylidene-7-hydroxy-6,14-dimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione

C₁₈H₂₅NO₆

(12xi,13xi)-12-Hydroxy-4-methyl-18-nor-4,8-secosenecionan-8,11,16-trione chemical structure, C18H25NO6

(12xi,13xi)-12-Hydroxy-4-methyl-18-nor-4,8-secosenecionan-8,11,16-trione

C₁₈H₂₅NO₆