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Murcko scaffold

Ring system with 3 rings and 15 atoms

15 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
15
Chemicals
15
With full pages
2
Scaffold SMILES

O=C1C=C2CCC3CCCCC3C2CC1

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 O=C1C=C2CCC3CCCCC3C2CC1

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 15 of 15 chemicals

4,4a,4b,5,6,7,8,8a,9,10-Decahydro-7-(1-hydroxy-1-methyl-2-propyn-1-yl)-2(3H)-phenanthrenone chemical structure, C18H24O2, CAS 605-57-2
4,4a,4b,5,6,7,8,8a,9,10-Decahydro-7-(1-hydroxy-1-methyl-2-propyn-1-yl)-2(3H)-phenanthrenone
CAS 605-57-2C18H24O2
Ro 2-7239 chemical structure, C16H22O2, CAS 2327-61-9
Ro 2-7239
CAS 2327-61-9C16H22O2
(1S,2S,4aS,4bR,10aR)-1-Ethyl-2-methyl-7-oxo-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydrophenanthrene-2-carboxylic acid chemical structure, C18H26O3, CAS 3727-71-7
(1S,2S,4aS,4bR,10aR)-1-Ethyl-2-methyl-7-oxo-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydrophenanthrene-2-carboxylic acid
CAS 3727-71-7C18H26O3
7,15-Dihydroxypodocarp-8(14)-en-13-one chemical structure, C17H26O3, CAS 262355-96-4
7,15-Dihydroxypodocarp-8(14)-en-13-one
CAS 262355-96-4C17H26O3
8a-Methyl-4,4a,4b,5,6,7,8,8a,9,10-decahydrophenanthren-2(3H)-one chemical structure, C15H22O, CAS 90036-89-8
8a-Methyl-4,4a,4b,5,6,7,8,8a,9,10-decahydrophenanthren-2(3H)-one
CAS 90036-89-8C15H22O
1,4a-Dimethyl-7-oxo-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid chemical structure, C17H24O3
1,4a-Dimethyl-7-oxo-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
C17H24O3
13-Oxopodocarp-8(14)-en-18-oic acid chemical structure, C17H24O3, CAS 63976-69-2
13-Oxopodocarp-8(14)-en-18-oic acid
CAS 63976-69-2C17H24O3
13-Oxopodocarp-8(14)-EN-18-oicacid chemical structure, C17H24O3
13-Oxopodocarp-8(14)-EN-18-oicacid
C17H24O3
(4aR,4bS,8aS)-4b,8,8-Trimethyl-1-propyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-one chemical structure, C20H32O, CAS 250720-36-6
(4aR,4bS,8aS)-4b,8,8-Trimethyl-1-propyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-one
CAS 250720-36-6C20H32O
7,15-Dihydroxypodocarp-8(14)-en-13-one chemical structure, C17H26O3
7,15-Dihydroxypodocarp-8(14)-en-13-one
C17H26O3
10-Hydroxy-8-(hydroxymethyl)-4b,8-dimethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-one chemical structure, C17H26O3
10-Hydroxy-8-(hydroxymethyl)-4b,8-dimethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-one
C17H26O3
(4aS,4bS,8S)-10-Hydroxy-8-(hydroxymethyl)-4b,8-dimethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-one chemical structure, C17H26O3
(4aS,4bS,8S)-10-Hydroxy-8-(hydroxymethyl)-4b,8-dimethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-one
C17H26O3
(4aS,4bR,8R)-10-Hydroxy-8-(hydroxymethyl)-4b,8-dimethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-one chemical structure, C17H26O3
(4aS,4bR,8R)-10-Hydroxy-8-(hydroxymethyl)-4b,8-dimethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-one
C17H26O3
(1R,4aS,4bR)-1,4a-Dimethyl-7-oxo-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid chemical structure, C17H24O3
(1R,4aS,4bR)-1,4a-Dimethyl-7-oxo-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
C17H24O3
13-Oxopodocarp-8(14)-ene-7alpha,18-diol chemical structure, C17H26O3
13-Oxopodocarp-8(14)-ene-7alpha,18-diol
C17H26O3