Murcko scaffold
Ring system with 4 rings and 46 atoms
11 chemicals on CompoundList share this ring system.
- Rings
- 4
- Scaffold atoms
- 46
- Chemicals
- 11
- With full pages
- 2
Scaffold SMILES
O=C(CCCO[PH](=O)O[PH](=O)OCC1CCC(n2cnc3cncnc32)O1)NCCC(=O)NCCSC(=O)CCc1ccccc1
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.
O[PH](=O)OCC1CCC(n2cnc3cncnc32)O1)NCCC(=O)NCCSC(=O)CCc1ccccc1](/scaffold/CXOYRMKGNZXYJI-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 11 of 11 chemicals
Coenzyme A, S-benzenepropanoate
CAS 117411-09-3C30H44N7O17P3S
![[Hydroxy(phenyl)methyl]succinyl-CoA chemical structure, C32H46N7O20P3S, CAS 1383686-26-7](/s/DVSQFPLMOLPRDU-ONDZYRKQSA-N.svg)
[Hydroxy(phenyl)methyl]succinyl-CoA
CAS 1383686-26-7C32H46N7O20P3S
(R)-Phenyllactoyl-CoA
CAS 100425-71-6C30H44N7O18P3S
3-(4-Sulfophenyl)butyrate-CoA
CAS 313250-63-4C31H46N7O20P3S2
beta-Phenylalanoyl-CoA
CAS 1622324-45-1C30H45N8O17P3S
p-Dihydrocoumaroyl-coenzyme A
CAS 95456-56-7C30H44N7O18P3S
Dihydrocaffeoyl-CoA
CAS 920318-19-0C30H44N7O19P3S
3-(3-Hydroxyphenyl)propionyl-coenzyme A
CAS 86630-22-0C30H44N7O18P3S
(R,S)-(Hydroxy(phenyl)methyl)succinyl-CoA
CAS 2857175-73-4C32H46N7O20P3S
Orb3144629
CAS 1862196-90-4C30H45N8O18P3S
Orb3144648
CAS 945411-96-1C30H45N8O19P3S
Related scaffolds
Same ring framework with different atoms or bond orders
O[PH](=O)OCC1CCC(n2cnc3cncnc32)O1)NCCC(=O)NCCSC(=O)C=Cc1ccccc1](/scaffold/OIRXAMRKZMSEAL-UHFFFAOYSA-N/structure.svg)