Murcko scaffold
Ring system with 10 rings and 38 atoms
9 chemicals on CompoundList share this ring system.
- Rings
- 10
- Scaffold atoms
- 38
- Chemicals
- 9
- With full pages
- 1
Scaffold SMILES
C=C1CNC2Cc3c([nH]c4ccccc34)C(c3ccc4c5c([nH]c4c3)C3CC4CCC3N(CC5)C4)CC1C2
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 C=C1CNC2Cc3c([nH]c4ccccc34)C(c3ccc4c5c([nH]c4c3)C3CC4CCC3N(CC5)C4)CC1C2](/scaffold/MCENZRDMNNDCCA-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 9 of 9 chemicals
![Ibogamine-18-carboxylic acid, 20-hydroxy-12-methoxy-13-[(3I+/-)-17-methoxy-17-oxovobasan-3-yl]-, methyl ester, (20R)- chemical structure, C43H52N4O6](/s/UIEKMUULTFWIHX-UHFFFAOYSA-N.svg)
Ibogamine-18-carboxylic acid, 20-hydroxy-12-methoxy-13-[(3I+/-)-17-methoxy-17-oxovobasan-3-yl]-, methyl ester, (20R)-
C43H52N4O6
Tabernamine
CAS 59626-92-5C40H48N4O2
Epivoacorine B811157K089
CAS 4835-65-8C43H52N4O6
Peribogamine
CAS 66302-66-7C39H46N4O2
Ibogamine-18-carboxylic acid, 13-((3alpha)-17-methoxy-17-oxovobasan-3-yl)-, methyl ester
CAS 80981-93-7C42H50N4O4
Voacorine
CAS 5130-80-3C43H52N4O6
Epivoacorine
C43H52N4O6
Gabunine
CAS 1357-30-8C42H50N4O5
Voacamine
CAS 3371-85-5C43H52N4O5