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Murcko scaffold

Ring system with 4 rings and 22 atoms

8 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
22
Chemicals
8
With full pages
2
Scaffold SMILES

O=C1Cc2ccccc2CNCCc2cc3c(cc21)OCO3

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=C1Cc2ccccc2CNCCc2cc3c(cc21)OCO3

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 8 of 8 chemicals

Allocryptopine chemical structure, C21H23NO5, CAS 485-91-6
Allocryptopine
CAS 485-91-6C21H23NO5
alpha-Fagarine hydrochloride chemical structure, C21H24ClNO5, CAS 5569-36-8
alpha-Fagarine hydrochloride
CAS 5569-36-8C21H24ClNO5
1-Methoxyallocryptopine chemical structure, C22H25NO6, CAS 56743-52-3
1-Methoxyallocryptopine
CAS 56743-52-3C22H25NO6
5,7,8,15-Tetrahydro-4-hydroxy-3-methoxy-6-methyl[1,3]benzodioxolo[5,6-e][2]benzazecin-14(6H)-one chemical structure, C20H21NO5, CAS 490-52-8
5,7,8,15-Tetrahydro-4-hydroxy-3-methoxy-6-methyl[1,3]benzodioxolo[5,6-e][2]benzazecin-14(6H)-one
CAS 490-52-8C20H21NO5
(±)-Corycavidine chemical structure, C22H25NO5, CAS 6018-34-4
(±)-Corycavidine
CAS 6018-34-4C22H25NO5
Corycavidine chemical structure, C22H25NO5, CAS 521-93-7
Corycavidine
CAS 521-93-7C22H25NO5
5,7,8,15-Tetrahydro-2,3-dimethoxy-6-methylbenzo[e][1,3]dioxolo[4,5-k][3]benzazecin-14(6H)-one chemical structure, C21H23NO5, CAS 528-67-6
5,7,8,15-Tetrahydro-2,3-dimethoxy-6-methylbenzo[e][1,3]dioxolo[4,5-k][3]benzazecin-14(6H)-one
CAS 528-67-6C21H23NO5
Corycavidine hydrochloride chemical structure, C22H26ClNO5, CAS 6020-20-8
Corycavidine hydrochloride
CAS 6020-20-8C22H26ClNO5