CompoundList
Sign in
Murcko scaffold

Ring system with 8 rings and 42 atoms

4 chemicals on CompoundList share this ring system.

Rings
8
Scaffold atoms
42
Chemicals
4
With full pages
1
Scaffold SMILES

C1CCC(OC2COC(OC3CCC4C(CCC5C4CCC4C6CCCC6CCC45)C3)C(OC3CCCCO3)C2)OC1

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 C1CCC(OC2COC(OC3CCC4C(CCC5C4CCC4C6CCCC6CCC45)C3)C(OC3CCCCO3)C2)OC1

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 4 of 4 chemicals

23-Hydroxy-3beta-((O-alpha-L-rhamnopyranosyl-(1->2)-O-(O-beta-D-glucopyranosyl-(1->4))-alpha-L-arabinopyranosyl)oxy)lup-20(29)-en-28-oic acid chemical structure, C47H76O17, CAS 848784-85-0
23-Hydroxy-3beta-((O-alpha-L-rhamnopyranosyl-(1->2)-O-(O-beta-D-glucopyranosyl-(1->4))-alpha-L-arabinopyranosyl)oxy)lup-20(29)-en-28-oic acid
CAS 848784-85-0C47H76O17
Orb3141650 chemical structure, C47H76O16, CAS 848784-87-2
Orb3141650
CAS 848784-87-2C47H76O16
Betulinic acid 3beta-O-alpha-L-rhamnopyranosyl chemical structure, C47H76O16
Betulinic acid 3beta-O-alpha-L-rhamnopyranosyl
C47H76O16
3beta-O-alpha-L-Rhamnopyranosyl-(1-->2)-[beta-D-glucopyranosyl-(1-->4)]-alpha-L-arabinopyranoside Betulinic Acid chemical structure, C47H76O16
3beta-O-alpha-L-Rhamnopyranosyl-(1-->2)-[beta-D-glucopyranosyl-(1-->4)]-alpha-L-arabinopyranoside Betulinic Acid
C47H76O16