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Murcko scaffold

Ring system with 4 rings and 17 atoms

8 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
17
Chemicals
8
With full pages
0
Scaffold SMILES

C1=CC2C(=CC1)CCC1C3CCCC3CCC21

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 C1=CC2C(=CC1)CCC1C3CCCC3CCC21

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 8 of 8 chemicals

3beta-Hydroxypregna-1,4-dien-20-one chemical structure, C21H30O2, CAS 20272-84-8
3beta-Hydroxypregna-1,4-dien-20-one
CAS 20272-84-8C21H30O2
4-Chloro-17-methyl-androsta-1,4-diene-3,17-diol, (3beta,17beta)- chemical structure, C20H29ClO2, CAS 1338221-84-3
4-Chloro-17-methyl-androsta-1,4-diene-3,17-diol, (3beta,17beta)-
CAS 1338221-84-3C20H29ClO2
Androsta-1,4-diene-3,17-diol, 4-chloro-17-methyl-, (3alpha,17beta)- chemical structure, C20H29ClO2, CAS 1338221-87-6
Androsta-1,4-diene-3,17-diol, 4-chloro-17-methyl-, (3alpha,17beta)-
CAS 1338221-87-6C20H29ClO2
(8R,9S,10R,13S,14S,17S)-4-Chloro-10,13,17-trimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthrene-3,17-diol chemical structure, C20H29ClO2, CAS 2389041-67-0
(8R,9S,10R,13S,14S,17S)-4-Chloro-10,13,17-trimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthrene-3,17-diol
CAS 2389041-67-0C20H29ClO2
(11beta,16alpha)-9-Fluoro-3,11,17,21-tetrahydroxy-16-methylpregna-1,4-dien-20-one chemical structure, C22H31FO5, CAS 922713-68-6
(11beta,16alpha)-9-Fluoro-3,11,17,21-tetrahydroxy-16-methylpregna-1,4-dien-20-one
CAS 922713-68-6C22H31FO5
17-Methyl-androsta-1,4-diene-3beta,17beta-diol chemical structure, C20H30O2, CAS 34347-66-5
17-Methyl-androsta-1,4-diene-3beta,17beta-diol
CAS 34347-66-5C20H30O2
Halodrol-50 chemical structure, C20H29ClO2
Halodrol-50
C20H29ClO2
Yhy6UT58EX chemical structure, C20H30O2, CAS 1978330-60-7
Yhy6UT58EX
CAS 1978330-60-7C20H30O2