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Murcko scaffold

Ring system with 4 rings and 18 atoms

9 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
18
Chemicals
9
With full pages
3
Scaffold SMILES

N=C1CC2C(CCC3CCCC32)c2ccccc21

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.

Substructure search with this scaffold
Murcko scaffold N=C1CC2C(CCC3CCCC32)c2ccccc21

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

2-[(3,17-Dihydroxy-13-methyl-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-6-ylidene)amino]oxyacetic acid chemical structure, C20H25NO5
2-[(3,17-Dihydroxy-13-methyl-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-6-ylidene)amino]oxyacetic acid
C20H25NO5
beta-Estradiol-6-one 6-(o-carboxymethyloxime) chemical structure, C20H25NO5
beta-Estradiol-6-one 6-(o-carboxymethyloxime)
C20H25NO5
beta-Estradiol-6-one 6-(o-carboxymethyloxime) chemical structure, C20H25NO5, CAS 66113-73-3
beta-Estradiol-6-one 6-(o-carboxymethyloxime)
CAS 66113-73-3C20H25NO5
Estradiol-6-(O-carboxymethyl)oxime chemical structure, C20H25NO5
Estradiol-6-(O-carboxymethyl)oxime
C20H25NO5
Estriol-6-(O-carboxymethyl)oxime chemical structure, C20H25NO6, CAS 37654-41-4
Estriol-6-(O-carboxymethyl)oxime
CAS 37654-41-4C20H25NO6
Estradiol-6 carboxyl-methyl-oxime chemical structure, C20H25NO5, CAS 35048-47-6
Estradiol-6 carboxyl-methyl-oxime
CAS 35048-47-6C20H25NO5
2-[(E)-[(8S,9R,13R,14R,17R)-3,17-Dihydroxy-13-methyl-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-6-ylidene]amino]oxyacetic acid chemical structure, C20H25NO5
2-[(E)-[(8S,9R,13R,14R,17R)-3,17-Dihydroxy-13-methyl-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-6-ylidene]amino]oxyacetic acid
C20H25NO5
2-[[(13S)-3,17-Dihydroxy-13-methyl-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-6-ylidene]amino]oxyacetic acid chemical structure, C20H25NO5
2-[[(13S)-3,17-Dihydroxy-13-methyl-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-6-ylidene]amino]oxyacetic acid
C20H25NO5
2-[(Z)-[(8R,9S,13R,14S,17S)-3,17-Dihydroxy-13-methyl-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-6-ylidene]amino]oxyacetic acid chemical structure, C20H25NO5
2-[(Z)-[(8R,9S,13R,14S,17S)-3,17-Dihydroxy-13-methyl-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-6-ylidene]amino]oxyacetic acid
C20H25NO5