Murcko scaffold
Ring system with 4 rings and 26 atoms
10 chemicals on CompoundList share this ring system.
- Rings
- 4
- Scaffold atoms
- 26
- Chemicals
- 10
- With full pages
- 4
Scaffold SMILES
O=C(c1ccc[nH]1)C1C(C=CC=CC2CCCCO2)C=CC2CCCC21
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(c1ccc[nH]1)C1C(C=CC=CC2CCCCO2)C=CC2CCCC21](/scaffold/WPBDFNCJPLCHDN-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 10 of 10 chemicals
![2-[6-[6-[1-Ethyl-4-(1H-pyrrole-2-carbonyl)-2,3,3a,4,5,7a-hexahydro-1H-inden-5-yl]hexa-3,5-dien-3-yl]-5-methyloxan-2-yl]propanoic acid chemical structure, C31H43NO4](/s/BAIPOTOKPGDCHA-UHFFFAOYSA-N.svg)
2-[6-[6-[1-Ethyl-4-(1H-pyrrole-2-carbonyl)-2,3,3a,4,5,7a-hexahydro-1H-inden-5-yl]hexa-3,5-dien-3-yl]-5-methyloxan-2-yl]propanoic acid
C31H43NO4
RefChem:914874
CAS 106803-22-9C29H39NO4
Antibiotic X 14547A
C31H43NO4
16-Deethylindanomycin
CAS 117615-33-5C29H39NO4
Cafamycin
CAS 112303-17-0C30H41NO4
Omomycin
C29H39NO4
Indanomycin
CAS 66513-28-8C31H43NO4
![(2R)-2-[(2R,5S,6R)-6-[(3E,5Z)-6-[(1S,3aR,4S,5S,7aS)-1-Ethyl-4-(1H-pyrrole-2-carbonyl)-2,3,3a,4,5,7a-hexahydro-1H-inden-5-yl]hexa-3,5-dien-3-yl]-5-methyloxan-2-yl]propanoic acid chemical structure, C31H43NO4](/s/BAIPOTOKPGDCHA-RJSRDJJWSA-N.svg)
(2R)-2-[(2R,5S,6R)-6-[(3E,5Z)-6-[(1S,3aR,4S,5S,7aS)-1-Ethyl-4-(1H-pyrrole-2-carbonyl)-2,3,3a,4,5,7a-hexahydro-1H-inden-5-yl]hexa-3,5-dien-3-yl]-5-methyloxan-2-yl]propanoic acid
C31H43NO4
Orb1694841
C31H43NO4
Antibiotic X 14547
C31H43NO4