Murcko scaffold
Ring system with 3 rings and 14 atoms
55 chemicals on CompoundList share this ring system.
- Rings
- 3
- Scaffold atoms
- 14
- Chemicals
- 55
- With full pages
- 13
Scaffold SMILES
C1=CC2=CCC3CCCCC3C2CC1
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 55 chemicals
Abietic acid
CAS 514-10-3C20H30O2
Calcium abietate
CAS 13463-98-4C40H58CaO4
Ethyl abietate
CAS 631-71-0C22H34O2
Diethylene glycol abietate
CAS 10107-99-0C24H38O4
Zinc abietate
CAS 6798-76-1C40H58O4Zn
Tall-oil rosin
CAS 8052-10-6C20H30O2
Abieta-7,13-dien-18-oyl chloride
CAS 56151-64-5C20H29ClO
Abietic acid, glyceryl ester
CAS 1337-89-9C23H38O5
1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, palladium(2+) salt (2:1), (1R,4aR,4bR,10aR)-
CAS 67816-10-8C40H58O4Pd
Manganese abietate, technical
CAS 54675-76-2C20H29MnO2+
2-Ethylhexyl 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate
CAS 13434-00-9C28H46O2
Magnesium abietate, technical
C40H58MgO4
15-Hydroperoxyabietic acid
CAS 113903-96-1C20H30O4
Abietyl acetate
CAS 54200-50-9C22H34O2
Methyl abietate
CAS 127-25-3C21H32O2
Bis(2-chloroethyl)abietic acid, amine salt
CAS 38234-11-6C24H39Cl2NO2
Methyl 6-hydroxy-4a-methyl-7-(propan-2-yl)-1,2,3,4,4a,4b,5,6,10,10a-decahydrophenanthrene-1-carboxylate--2-chloro-N-(2-chloroethyl)ethan-1-amine (1/1)
CAS 38234-12-7C24H39Cl2NO3
12-(Hydroxymethyl)abieta-7,13-dien-18-oic acid
CAS 2442-83-3C21H32O3
Abieta-7,13-diene
CAS 35241-40-8C20H32
Abietinol
CAS 666-84-2C20H32O
Abietinal
CAS 6704-50-3C20H30O
(1R,4aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a,4b,5,6,10,10a-decahydrophenanthrene-1-carboxylic acid
CAS 1637665-47-4C20H30O2
Glycerol ester OF rosin
CAS 8050-30-4C23H36O4
Glyceryl 1-abietate
CAS 186374-50-5C23H36O4
- Glyceryl 2-abietate100332-99-8C23H36O4
- Magnesium abietate30004-10-5C40H58MgO4
- Potassium abietate23250-44-4C20H29KO2
- Sodium abietate14351-66-7C20H29NaO2
- Tributyltin abietate26239-64-5C32H56O2Sn
- Silicic acid, ((1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenyl)methyl) ester, (1R-(1alpha,4abeta,4balpha,10aalpha))-100402-41-3C20H32O3Si
- Tin, tributyl(13-isopropylpodocarpa-7,13-dien-15-oyl)-13387-91-2C32H56OSn
- (1R-(1alpha,4abeta,4balpha,10aalpha))-1,2,3,4,4a,4b,5,6,10,10a-Decahydro-7-isopropyl-1,4a-dimethylphenanthren-1-methylamine hydrochloride71463-36-0C20H34ClN
- Abietylamine47117-16-8C20H33N
- 4-[[(1R,4aR,4bR,10aR)-1,4a-Dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthren-1-yl]methoxy]-4-oxobutanoic acid135092-56-7C24H36O4
- 12-Hydroxyabietic acid3484-61-5C20H30O3
- Nickel abietate, Ni(O2C20H29)27153-11-9C20H30NiO2
- Abieta-7,13-dien-18-oic acid--lead (1/1)5434-72-0C20H30O2Pb
- Copper abietate10248-55-2C40H58CuO4
- (1R-(1alpha,4abeta,4balpha,10aalpha))-(1,2,3,4,4a,4b,5,6,10,10a-Decahydro-7-isopropyl-1,4a-dimethyl-1-phenanthryl)methyl methacrylate68877-48-5C24H36O2
- Pentaerythritol abietate890028-17-8C25H40O5
- Silver abietate13962-31-7C20H29AgO2
- Bis((1S,4aR,4bS)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate), cobalt(2+)26998-20-9C40H58CoO4
- Magnesium bis((1S,4aR,4bS)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate)C40H58MgO4
- Indium tris(1R-(1alpha,4abeta,4balpha,10aalpha))-1,2,3,4,4a,4b,5,6,10,10a-decahydro-7-isopropyl-1,4a-dimethylphenanthren-1-carboxylate84012-59-9C60H87InO6
- Iron triabietate1280215-93-1C20H30FeO2
- Calcium bis((1R,4aR,4bR,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate)C40H58CaO4
- (1S,4aR,4bS)-1,4a-Dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate, tris((1R,4aS,4bR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate), tin(4+)39717-39-0C80H116O8Sn
- 1 suppliers12-Acetoxyabietic acid83905-81-1C22H32O4
Related scaffolds
Same ring framework with different atoms or bond orders
c1ccc2c(c1)ccc1ccccc12104 chemicals
c1cnc2c(c1)ccc1cccnc1262 chemicals
O=c1oc2ccccc2c2c1CCCC243 chemicals
c1ccc2c(c1)CCC1CCCCC2140 chemicals
O=c1oc2ccccc2c2ccccc1240 chemicals
O=c1ccc2ccc3c(c2o1)CCCO339 chemicals
C1=CC2c3ccccc3OCC2CC124 chemicals
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