Murcko scaffold
Ring system with 3 rings and 15 atoms
16 chemicals on CompoundList share this ring system.
- Rings
- 3
- Scaffold atoms
- 15
- Chemicals
- 16
- With full pages
- 5
Scaffold SMILES
O=C1C=C2CCCCC2c2ccccc21
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.
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 16 of 16 chemicals
Coleon U 12 methyl ether
CAS 65714-80-9C21H28O5
Sugiol,5-dehydro
CAS 21764-42-1C20H26O2
Methyl 6-methoxy-1,4a-dimethyl-9-oxo-3,4-dihydro-2H-phenanthrene-1-carboxylate
CAS 37931-65-0C19H22O4
6-Methoxy-1,4a-dimethyl-1,2,3,4-tetrahydrophenanthren-9-one
CAS 37931-66-1C17H20O2
Coleon U
CAS 65714-69-4C20H26O5
(4aR)-6,10-Dihydroxy-1,1,4a-trimethyl-7-propan-2-yl-3,4-dihydro-2H-phenanthren-9-one
CAS 140923-35-9C20H26O3
Celaphanol A
CAS 244204-40-8C17H20O4
14-Deoxycoleon U
CAS 88664-09-9C20H26O4
(4aR)-2,3,4,4a-Tetrahydro-10-hydroxy-6-methoxy-1,1,4a-trimethyl-7-(1-methylethyl)-9(1H)-phenanthrenone
CAS 140670-85-5C21H28O3
Salvinolone
CAS 120278-22-0C20H26O3
(4aR)-2,3,4,4a-Tetrahydro-6,10-dihydroxy-7-(1-hydroxy-1-methylethyl)-1,1,4a-trimethyl-9(1H)-phenanthrenone
CAS 371155-09-8C20H26O4
1-Phenanthrenecarboxylic acid, 10-(acetyloxy)-1,2,3,4,4a,9-hexahydro-1,4a-dimethyl-9-oxo-, methyl ester, (1R-cis)-
CAS 60483-24-1C20H22O5
6-Hydroxy-5,6-dehydrosugiol
C20H26O3
Graciliflorin E
CAS 1413941-66-8C21H28O4
Graciliflorin F
CAS 1413941-67-9C22H28O6
15-O-Methylgraciliflorin F
CAS 1411994-51-8C23H30O6