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Murcko scaffold

Ring system with 5 rings and 25 atoms

11 chemicals on CompoundList share this ring system.

Rings: 5
Scaffold atoms: 25
Chemicals: 11
With full pages: 2

Scaffold SMILES

c1ccc(COc2ccc3c(c2)CCC2C3CCC3CCCC32)cc1

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 c1ccc(COc2ccc3c(c2)CCC2C3CCC3CCCC32)cc1

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

3-[(4-Fluorophenyl)methoxy]estra-1,3,5(10)-trien-17alpha-yl pentanoate chemical structure, C30H37FO3, CAS 1286734-97-1

3-[(4-Fluorophenyl)methoxy]estra-1,3,5(10)-trien-17alpha-yl pentanoate

CAS 1286734-97-1C₃₀H₃₇FO₃

3-O-Benzyl estradiol chemical structure, C25H30O2, CAS 14982-15-1

3-O-Benzyl estradiol

CAS 14982-15-1C₂₅H₃₀O₂

3-O-Benzyl estriol chemical structure, C25H30O3, CAS 18650-87-8

3-O-Benzyl estriol

CAS 18650-87-8C₂₅H₃₀O₃

(17alpha)-3-(Benzyloxy)estra-1,3,5(10)-trien-17-ol chemical structure, C25H30O2, CAS 23880-59-3

(17alpha)-3-(Benzyloxy)estra-1,3,5(10)-trien-17-ol

CAS 23880-59-3C₂₅H₃₀O₂

3-O-Benzyl 16-epiestriol chemical structure, C25H30O3, CAS 33116-58-4

3-O-Benzyl 16-epiestriol

CAS 33116-58-4C₂₅H₃₀O₃

3-O-Benzyl 17-epiestriol chemical structure, C25H30O3, CAS 1316291-21-0

3-O-Benzyl 17-epiestriol

CAS 1316291-21-0C₂₅H₃₀O₃

(16alpha,17alpha)-3-(Benzyloxy)-15,16-dihydroxyestra-1,3,5(10)-trien-17-yl acetate chemical structure, C27H32O5, CAS 690996-24-8

(16alpha,17alpha)-3-(Benzyloxy)-15,16-dihydroxyestra-1,3,5(10)-trien-17-yl acetate

CAS 690996-24-8C₂₇H₃₂O₅

(8R,9S,13S,14S,15R,16R,17R)-13-Metil-3-fenilmetossi-6,7,8,9,11,12,14,15,16,17-decaidrociclopenta[a]fenantren-15, 16,17-triolo chemical structure, C25H30O4, CAS 1426679-35-7

(8R,9S,13S,14S,15R,16R,17R)-13-Metil-3-fenilmetossi-6,7,8,9,11,12,14,15,16,17-decaidrociclopenta[a]fenantren-15, 16,17-triolo

CAS 1426679-35-7C₂₅H₃₀O₄

3-O-Benzyl estetrol 17-acetate chemical structure, C27H32O5

3-O-Benzyl estetrol 17-acetate

C₂₇H₃₂O₅

(13S,15R)-15-(3-Hydroxypropyl)-13-methyl-3-phenylmethoxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol chemical structure, C28H36O3, CAS 1642579-13-2

(13S,15R)-15-(3-Hydroxypropyl)-13-methyl-3-phenylmethoxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol

CAS 1642579-13-2C₂₈H₃₆O₃

[(8R,9S,13S,14S,15R,16R,17R)-15,16-Dihydroxy-13-methyl-3-phenylmethoxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] acetate chemical structure, C27H32O5

[(8R,9S,13S,14S,15R,16R,17R)-15,16-Dihydroxy-13-methyl-3-phenylmethoxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] acetate

C₂₇H₃₂O₅