Murcko scaffold
1,2,3,4,4a,9,10,10a-Octahydrophenanthrene scaffold
260 chemicals on CompoundList share this ring system.
- Rings
- 3
- Scaffold atoms
- 14
- Chemicals
- 260
- With full pages
- 40
Scaffold SMILES
c1ccc2c(c1)CCC1CCCCC21
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.
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 260 chemicals
Methyl dehydroabietate
CAS 1235-74-1C21H30O2
1,4a-Dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid
CAS 112989-11-4C20H28O2
Methyl podocarpa-8,11,13-triem-15-oate
CAS 3650-04-2C18H24O2
13-Isopropylpodocarpa-8,11,13-trien-16-oic acid
CAS 5155-70-4C20H28O2
Podocarpa-8,11,13-trien-12-ol
CAS 15340-76-8C17H24O
Podocarpa-8,11,13-trien-15-oic acid
CAS 57345-30-9C17H22O2
12,14-Dichlorodehydroabietic acid
CAS 65281-77-8C20H26Cl2O2
![2-[2-[(1,4a-Dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl)methyl-[2-(2-hydroxyethoxy)ethyl]amino]ethoxy]ethanol chemical structure, C28H47NO4, CAS 51344-62-8](/s/VLPYRWWGAIPYJI-UHFFFAOYSA-N.svg)
2-[2-[(1,4a-Dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl)methyl-[2-(2-hydroxyethoxy)ethyl]amino]ethoxy]ethanol
CAS 51344-62-8C28H47NO4
Dehydroabietylamine
CAS 1446-61-3C20H31N
Carnosic acid
CAS 3650-09-7C20H28O4
Ecabet
CAS 33159-27-2C20H28O5S
(+)-Totarol
CAS 511-15-9C20H30O
Podocarpic acid
CAS 5947-49-9C17H22O3
Dehydroabietic acid
CAS 1740-19-8C20H28O2
Dehydroabietonitrile
CAS 18063-45-1C20H27N
1-Ethyl-7-hydroxy-2-methyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-2-carboxylic acid
CAS 109784-48-7C18H24O3
Abieta-8,11,13-trien-18-amine
CAS 24978-68-5C20H31N
14-Chlorodehydroabietic acid
CAS 65281-76-7C20H27ClO2
12-Chlorodehydroabietic acid
CAS 65310-45-4C20H27ClO2
14,15-Secoestra-1,3,5(10)-trien-15-yne-3,17-diol
CAS 104849-39-0C18H22O2
1,2,3,4,4a,9,10,10a-Octahydrophenanthrene, trans-
CAS 20480-67-5C14H18
Spruceanol
CAS 72963-56-5C20H28O2
1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-2-hydroxy-1,4a-dimethyl-7-(1-methylethenyl)-, (1S,2S,4aS,10aR)-
CAS 77091-10-2C20H26O3
(4aR,10aS)-1,3,4,9,10,10a-Hexahydro-6-hydroxy-1,1-dimethyl-7-(1-methylethyl)-4a(2H)-phenanthrenecarboxylic acid
CAS 67494-15-9C20H28O3
- Nimbosone19889-21-5C20H28O2
- Euphracal126005-98-9C20H28O4
- Euphraticol126005-99-0C20H30O3
- Pisiferol24035-36-7C20H30O2
- Methyl (1R,3S,4aS,10aS)-8-chloro-3-hydroxy-7-(2-hydroxypropan-2-yl)-4a-methyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylate83353-98-4C20H27ClO4
- 1-Phenanthrenecarboxylic acid, 3-(acetyloxy)-7-(2-(acetyloxy)-1-hydroxy-1-methylethyl)-8-chloro-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-, methyl ester83354-01-2C25H33ClO7
- Methyl (1R,3R,4aS,10aR)-6,8-dichloro-3-hydroxy-7-[(2S)-1-hydroxypropan-2-yl]-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate86547-14-0C21H28Cl2O4
- 1-Phenanthrenecarboxylic acid, 6-chloro-1,2,3,4,4a,9,10,10a-octahydro-3-hydroxy-1,4a-dimethyl-7-(1-methylethyl)-, (1R-(1alpha,3alpha,4abeta,10aalpha))-88147-74-4C20H27ClO3
- Methyl 6-chloro-7-(1-hydroxypropan-2-yl)-4a-methyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylate88147-75-5C20H27ClO3
- (1R,3R,4aS,10aR)-6-Chloro-3-hydroxy-7-((2R)-1-hydroxypropan-2-yl)-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid88147-76-6C20H27ClO4
- (1R,3R,4aS,10aR)-6-Chloro-3-hydroxy-7-[(2S)-1-hydroxypropan-2-yl]-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid88147-77-7C20H27ClO4
- Methyl (1R,3S,4AS,10AS)-8-chloro-3-hydroxy-4A-methyl-7-(propan-2-yl)-1,2,3,4,4A,9,10,10A-octahydrophenanthrene-1-carboxylate83353-96-2C20H27ClO3
- Methyl 14-chloro-2-hydroxyabieta-8,11,13-trien-18-oate83353-97-3C21H29ClO3
- Methyl 2-(acetyloxy)-14-chloro-15-hydroxyabieta-8,11,13-trien-18-oate83353-99-5C23H31ClO5
- 1-Phenanthrenecarboxylic acid, 3-(acetyloxy)-7-(2-(acetyloxy)-1-methylethyl)-8-chloro-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-, methyl ester83354-00-1C25H33ClO6
- Methyl 8-chloro-3-hydroxy-7-(1-hydroxypropan-2-yl)-4a-methyl-2,3,4,9,10,10a-hexahydro-1H-phenanthrene-1-carboxylate83400-64-0C20H27ClO4
- Methyl 8-chloro-7-(1,2-dihydroxypropan-2-yl)-3-hydroxy-4a-methyl-2,3,4,9,10,10a-hexahydro-1H-phenanthrene-1-carboxylate83400-65-1C20H27ClO5
- 1-Phenanthrenecarboxylic acid, 6,8-dichloro-1,2,3,4,4a,9,10,10a-octahydro-3-hydroxy-7-(2-hydroxy-1-methylethyl)-1,4a-dimethyl-86547-09-3C20H26Cl2O4
- 1-Phenanthrenecarboxylic acid, 3-(acetyloxy)-7-(2-(acetyloxy)-1-methylethyl)-6,8-dichloro-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-, methyl ester86547-15-1C25H32Cl2O6
- Methyl (1R,3R,4aS,10aR)-6,8-dichloro-3-hydroxy-7-[(2R)-1-hydroxypropan-2-yl]-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate86547-20-8C21H28Cl2O4
- (1R,4aS,10aR)-N-[2-(Diethylamino)ethyl]-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxamide27527-13-5C26H42N2O
- Trifluoromethylacetylene methyl alcohol128496-66-2C19H21F3O2
- Nordehydroabietane5323-56-8C19H28
- 1-Phenanthrenecarbonitrile, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, (1R,4aS,10aR)-31148-95-5C20H27N
Related scaffolds
Same ring framework with different atoms or bond orders
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O=c1oc2ccccc2c2c1CCCC243 chemicals
O=c1oc2ccccc2c2ccccc1240 chemicals
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c1ccc2c(c1)CCc1ccccc1-224 chemicals
c1ccc2c(c1)CCN1CCCCC2119 chemicals
C1=CCC2c3ccccc3OCC2C118 chemicals![Scaffold O=c1[nH]c2ccccc2c2ccccc12](/scaffold/RZFVLEJOHSLEFR-UHFFFAOYSA-N/structure.svg)
O=c1[nH]c2ccccc2c2ccccc1216 chemicals
C1=C2CCC3CCCCC3C2CCC114 chemicals
C1=CC2=CCC3CCCCC3C2CC113 chemicals