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Murcko scaffold

4a,5,6,7,8,8a-Hexahydronaphthalen-2(1H)-one scaffold

49 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
11
Chemicals
49
With full pages
1
Scaffold SMILES

O=C1C=CC2CCCCC2C1

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 scaffoldOpen the 4a,5,6,7,8,8a-Hexahydronaphthalen-2(1H)-one page
Murcko scaffold O=C1C=CC2CCCCC2C1

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 48 of 49 chemicals

4a,5,6,7,8,8a-Hexahydro-3,8-dimethyl-5-(1-methylethyl)naphthalen-2(1H)-one chemical structure, C15H24O, CAS 97752-23-3
4a,5,6,7,8,8a-Hexahydro-3,8-dimethyl-5-(1-methylethyl)naphthalen-2(1H)-one
CAS 97752-23-3C15H24O
Chamaecynone chemical structure, C14H18O, CAS 10208-54-5
Chamaecynone
CAS 10208-54-5C14H18O
1,4a-Dimethyl-4a,5,6,7,8,8a-hexahydronaphthalen-2(1H)-one chemical structure, C12H18O, CAS 56763-86-1
1,4a-Dimethyl-4a,5,6,7,8,8a-hexahydronaphthalen-2(1H)-one
CAS 56763-86-1C12H18O
8a-Methyl-4a,5,6,7,8,8a-hexahydro-2(1H)-naphthalenone chemical structure, C11H16O, CAS 32980-06-6
8a-Methyl-4a,5,6,7,8,8a-hexahydro-2(1H)-naphthalenone
CAS 32980-06-6C11H16O
2(1H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-7alpha-isopropyl-4abeta,8abeta-dimethyl- chemical structure, C15H24O, CAS 17408-66-1
2(1H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-7alpha-isopropyl-4abeta,8abeta-dimethyl-
CAS 17408-66-1C15H24O
6-(Acetyloxy)-4a,5,6,7,8,8a-hexahydro-8-(3-hydroxy-3-methyl-4-pentenyl)-4,4a,7,8-tetramethyl-2(1H)-naphthalenone chemical structure, C22H34O4, CAS 11055-83-7
6-(Acetyloxy)-4a,5,6,7,8,8a-hexahydro-8-(3-hydroxy-3-methyl-4-pentenyl)-4,4a,7,8-tetramethyl-2(1H)-naphthalenone
CAS 11055-83-7C22H34O4
Stachysolon, diacetate chemical structure, C24H36O5, CAS 11055-84-8
Stachysolon, diacetate
CAS 11055-84-8C24H36O5
8-(3-(Acetyloxy)-3-methyl-4-pentenyl)-4a,5,6,7,8,8a-hexahydro-6-hydroxy-4,4a,7,8-tetramethyl-2(1H)-naphthalenone chemical structure, C22H34O4, CAS 11055-86-0
8-(3-(Acetyloxy)-3-methyl-4-pentenyl)-4a,5,6,7,8,8a-hexahydro-6-hydroxy-4,4a,7,8-tetramethyl-2(1H)-naphthalenone
CAS 11055-86-0C22H34O4
6-Hydroxy-8-(3-hydroxy-3-methylpent-4-enyl)-4,4a,7,8-tetramethyl-5,6,7,8a-tetrahydro-1H-naphthalen-2-one chemical structure, C20H32O3, CAS 1217743-31-1
6-Hydroxy-8-(3-hydroxy-3-methylpent-4-enyl)-4,4a,7,8-tetramethyl-5,6,7,8a-tetrahydro-1H-naphthalen-2-one
CAS 1217743-31-1C20H32O3
8-(3-Hydroxy-3-methylpent-4-enyl)-4,4a,7,8-tetramethyl-5,6,7,8a-tetrahydro-1H-naphthalen-2-one chemical structure, C20H32O2, CAS 7235-04-3
8-(3-Hydroxy-3-methylpent-4-enyl)-4,4a,7,8-tetramethyl-5,6,7,8a-tetrahydro-1H-naphthalen-2-one
CAS 7235-04-3C20H32O2
5,6-Dihydroxy-3-(2-hydroxypropan-2-yl)-5,8a-dimethyl-4a,6,7,8-tetrahydro-1H-naphthalen-2-one chemical structure, C15H24O4, CAS 7236-03-5
5,6-Dihydroxy-3-(2-hydroxypropan-2-yl)-5,8a-dimethyl-4a,6,7,8-tetrahydro-1H-naphthalen-2-one
CAS 7236-03-5C15H24O4
2-Oxokolavelool chemical structure, C20H32O2, CAS 221466-41-7
2-Oxokolavelool
CAS 221466-41-7C20H32O2
Petasitolone chemical structure, C15H24O2, CAS 35124-22-2
Petasitolone
CAS 35124-22-2C15H24O2
beta-Rotunol chemical structure, C15H22O2, CAS 24405-57-0
beta-Rotunol
CAS 24405-57-0C15H22O2
Hynapene B chemical structure, C18H24O3, CAS 155111-88-9
Hynapene B
CAS 155111-88-9C18H24O3
Xenitorin E chemical structure, C15H22O2, CAS 479199-48-9
Xenitorin E
CAS 479199-48-9C15H22O2
(4aR,5R,6S,8aR)-3-Acetyl-6-hydroxy-4a,5-dimethyl-1,5,6,7,8,8a-hexahydronaphthalen-2-one chemical structure, C14H20O3, CAS 163135-94-2
(4aR,5R,6S,8aR)-3-Acetyl-6-hydroxy-4a,5-dimethyl-1,5,6,7,8,8a-hexahydronaphthalen-2-one
CAS 163135-94-2C14H20O3
(4aR,5S,8aR)-4a,5,6,7,8,8a-Hexahydro-3-(1-hydroxyethyl)-4a,5-dimethyl-2(1H)-naphthalenone chemical structure, C14H22O2, CAS 348615-40-7
(4aR,5S,8aR)-4a,5,6,7,8,8a-Hexahydro-3-(1-hydroxyethyl)-4a,5-dimethyl-2(1H)-naphthalenone
CAS 348615-40-7C14H22O2
(4aR,8S,8aR)-3,4,4a,5,6,7,8,8a-Octahydro-8,8a-dimethyl-3-oxo-2-naphthalenecarboxaldehyde chemical structure, C13H18O2, CAS 348119-86-8
(4aR,8S,8aR)-3,4,4a,5,6,7,8,8a-Octahydro-8,8a-dimethyl-3-oxo-2-naphthalenecarboxaldehyde
CAS 348119-86-8C13H18O2
(4aR,5S,8aR)-3-Acetyl-4a,5,6,7,8,8a-hexahydro-4a,5-dimethyl-2(1H)-naphthalenone chemical structure, C14H20O2, CAS 348119-85-7
(4aR,5S,8aR)-3-Acetyl-4a,5,6,7,8,8a-hexahydro-4a,5-dimethyl-2(1H)-naphthalenone
CAS 348119-85-7C14H20O2
10alpha-Hydroxyamorph-4-en-3-one chemical structure, C15H24O2, CAS 185308-74-1
10alpha-Hydroxyamorph-4-en-3-one
CAS 185308-74-1C15H24O2
Ainigmaptilone A chemical structure, C15H22O2, CAS 553641-40-0
Ainigmaptilone A
CAS 553641-40-0C15H22O2
Xenitorin F chemical structure, C15H22O2, CAS 479199-49-0
Xenitorin F
CAS 479199-49-0C15H22O2
(4aS,6R,8aS)-4a-Hydroxy-4,8a-dimethyl-6-prop-1-en-2-yl-5,6,7,8-tetrahydro-1H-naphthalen-2-one chemical structure, C15H22O2, CAS 24405-56-9
(4aS,6R,8aS)-4a-Hydroxy-4,8a-dimethyl-6-prop-1-en-2-yl-5,6,7,8-tetrahydro-1H-naphthalen-2-one
CAS 24405-56-9C15H22O2