Murcko scaffold
Ring system with 6 rings and 33 atoms
6 chemicals on CompoundList share this ring system.
- Rings
- 6
- Scaffold atoms
- 33
- Chemicals
- 6
- With full pages
- 0
Scaffold SMILES
O=C(NCC(=O)N1CC(=O)N2CCCC2C1=O)C1C=C2c3cccc4[nH]cc(c34)CC2NC1
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=C(NCC(=O)N1CC(=O)N2CCCC2C1=O)C1C=C2c3cccc4[nH]cc(c34)CC2NC1](/scaffold/AABVUXIKFVBYDQ-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 6 of 6 chemicals
Ergocornam
CAS 77477-94-2C31H39N5O4
![N-{1-[3-(Butan-2-yl)-1,4-dioxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-3-methyl-1-oxopentan-2-yl}-6-methyl-9,10-didehydroergoline-8-carboximidic acid chemical structure, C33H43N5O4](/s/IHDIXBZKTTXKMY-UHFFFAOYSA-N.svg)
N-{1-[3-(Butan-2-yl)-1,4-dioxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-3-methyl-1-oxopentan-2-yl}-6-methyl-9,10-didehydroergoline-8-carboximidic acid
C33H43N5O4
Ergocryptam
CAS 77477-95-3C32H41N5O4
beta-Ergocryptam
CAS 97387-94-5C32H41N5O4
Ergoannam
CAS 97387-95-6C33H43N5O4
Ergocryptinam
CAS 77519-66-5C32H41N5O4