CompoundList
Sign in
Murcko scaffold

Ring system with 8 rings and 45 atoms

6 chemicals on CompoundList share this ring system.

Rings
8
Scaffold atoms
45
Chemicals
6
With full pages
2
Scaffold SMILES

C1=C(CCCCOC2CCCCO2)OC2CC3C(CCC4C5CCC(OC6OCCCC6OC6CCCCO6)CC5CCC43)C12

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 C1=C(CCCCOC2CCCCO2)OC2CC3C(CCC4C5CCC(OC6OCCCC6OC6CCCCO6)CC5CCC43)C12

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 6 of 6 chemicals

Anemarsaponin B chemical structure, C45H74O18, CAS 139051-27-7
Anemarsaponin B
CAS 139051-27-7C45H74O18
Macrostemonoside F chemical structure, C45H74O18, CAS 151215-11-1
Macrostemonoside F
CAS 151215-11-1C45H74O18
Pseudoprototimosaponin aiii chemical structure, C45H74O18, CAS 142759-74-8
Pseudoprototimosaponin aiii
CAS 142759-74-8C45H74O18
I(2)-D-Glucopyranoside, (2I+/-,3I(2),5I+/-,25S)-26-(I(2)-D-glucopyranosyloxy)-2-hydroxyfurost-20(22)-en-3-yl 2-O-(6-deoxy-I+/--L-mannopyranosyl)- chemical structure, C45H74O18, CAS 259810-65-6
I(2)-D-Glucopyranoside, (2I+/-,3I(2),5I+/-,25S)-26-(I(2)-D-glucopyranosyloxy)-2-hydroxyfurost-20(22)-en-3-yl 2-O-(6-deoxy-I+/--L-mannopyranosyl)-
CAS 259810-65-6C45H74O18
Timosaponin C chemical structure, C45H74O18, CAS 185432-00-2
Timosaponin C
CAS 185432-00-2C45H74O18
Orb2663467 chemical structure, C45H74O19, CAS 220095-97-6
Orb2663467
CAS 220095-97-6C45H74O19