Murcko scaffold
Ring system with 11 rings and 43 atoms
8 chemicals on CompoundList share this ring system.
- Rings
- 11
- Scaffold atoms
- 43
- Chemicals
- 8
- With full pages
- 1
Scaffold SMILES
O=C1OCC2c3c(ccc4c3OCO4)C(SCC13NCCc1c3[nH]c3ccccc13)C1C3NC(Cc4ccccc43)CN21
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.
![Murcko scaffold O=C1OCC2c3c(ccc4c3OCO4)C(SCC13NCCc1c3[nH]c3ccccc13)C1C3NC(Cc4ccccc43)CN21](/scaffold/GSSJIBLUTINAKG-UHFFFAOYSA-N/structure.svg)
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
Lurbinectedin
CAS 497871-47-3C41H44N4O10S
Lurbinectedin metabolite M4
CAS 577748-36-8C40H42N4O10S
Ecubectedin
CAS 2248127-53-7C41H44N4O10S
Lurbinectedin-d3
CAS 2728715-06-6C41H44N4O10S
Lurbinectedin impurity 12
CAS 497871-10-0C42H43N5O9S
Gpx66GJ9DZ
CAS 2728715-39-5C44H47N5O10S
54Z5YQ5Rpm
CAS 3054883-63-2C39H42N4O9S
Orb3210155
CAS 497871-20-2C41H41N5O9S