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Murcko scaffold

Ring system with 3 rings and 16 atoms

15 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
16
Chemicals
15
With full pages
6
Scaffold SMILES

O=c1oc2ccccc2c2c1CCCCC2

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=c1oc2ccccc2c2c1CCCCC2

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 15 of 15 chemicals

3-(2-Oxopropoxy)-8,9,10,11-tetrahydrocyclohepta[c]chromen-6(7H)-one chemical structure, C17H18O4, CAS 447446-24-4
3-(2-Oxopropoxy)-8,9,10,11-tetrahydrocyclohepta[c]chromen-6(7H)-one
CAS 447446-24-4C17H18O4
4-Methyl-3-(2-oxopropoxy)-8,9,10,11-tetrahydrocyclohepta[c]chromen-6(7H)-one chemical structure, C18H20O4, CAS 578763-29-8
4-Methyl-3-(2-oxopropoxy)-8,9,10,11-tetrahydrocyclohepta[c]chromen-6(7H)-one
CAS 578763-29-8C18H20O4
3-(1-Methyl-2-oxopropoxy)-8,9,10,11-tetrahydrocyclohepta[c]chromen-6(7H)-one chemical structure, C18H20O4, CAS 573947-55-4
3-(1-Methyl-2-oxopropoxy)-8,9,10,11-tetrahydrocyclohepta[c]chromen-6(7H)-one
CAS 573947-55-4C18H20O4
4-Methyl-3-(1-methyl-2-oxopropoxy)-8,9,10,11-tetrahydrocyclohepta[c]chromen-6(7H)-one chemical structure, C19H22O4, CAS 587009-51-6
4-Methyl-3-(1-methyl-2-oxopropoxy)-8,9,10,11-tetrahydrocyclohepta[c]chromen-6(7H)-one
CAS 587009-51-6C19H22O4
Irosustat chemical structure, C14H15NO5S, CAS 288628-05-7
Irosustat
CAS 288628-05-7C14H15NO5S
3-Hydroxy-4-methyl-8,9,10,11-tetrahydrocyclohepta[c]chromen-6(7H)-one chemical structure, C15H16O3, CAS 431983-60-7
3-Hydroxy-4-methyl-8,9,10,11-tetrahydrocyclohepta[c]chromen-6(7H)-one
CAS 431983-60-7C15H16O3
3-Hydroxy-2-propyl-8,9,10,11-tetrahydro-7H-cyclohepta[c]chromen-6-one chemical structure, C17H20O3, CAS 67901-21-7
3-Hydroxy-2-propyl-8,9,10,11-tetrahydro-7H-cyclohepta[c]chromen-6-one
CAS 67901-21-7C17H20O3
3-Hydroxy-8,9,10,11-tetrahydrocyclohepta[c]chromen-6(7H)-one chemical structure, C14H14O3, CAS 83688-44-2
3-Hydroxy-8,9,10,11-tetrahydrocyclohepta[c]chromen-6(7H)-one
CAS 83688-44-2C14H14O3
4-Dimethylaminomethyl-3-hydroxy-8,9,10,11-tetrahydro-7H-cyclohepta[c]chromen-6-one chemical structure, C17H21NO3, CAS 843624-10-2
4-Dimethylaminomethyl-3-hydroxy-8,9,10,11-tetrahydro-7H-cyclohepta[c]chromen-6-one
CAS 843624-10-2C17H21NO3
9-Oxo-8-oxatricyclo[8.5.0.0^{2,7}]pentadeca-1(10),2(7),3,5-tetraen-5-yl N,N-dimethylsulfamate chemical structure, C16H19NO5S, CAS 590375-53-4
9-Oxo-8-oxatricyclo[8.5.0.0^{2,7}]pentadeca-1(10),2(7),3,5-tetraen-5-yl N,N-dimethylsulfamate
CAS 590375-53-4C16H19NO5S
Irosustat metabolite M17 chemical structure, C14H13O6S-, CAS 319929-11-8
Irosustat metabolite M17
CAS 319929-11-8C14H13O6S-
Irosustat metabolite M8 chemical structure, C14H14O4, CAS 1349195-18-1
Irosustat metabolite M8
CAS 1349195-18-1C14H14O4
Irosustat metabolite M14 chemical structure, C14H15NO6S, CAS 1349195-19-2
Irosustat metabolite M14
CAS 1349195-19-2C14H15NO6S
8-Hydroxy irosustat chemical structure, C14H15NO6S, CAS 1349195-20-5
8-Hydroxy irosustat
CAS 1349195-20-5C14H15NO6S
Irosustat metabolite M7 chemical structure, C14H15NO6S, CAS 1349195-17-0
Irosustat metabolite M7
CAS 1349195-17-0C14H15NO6S