Murcko scaffold
Ring system with 2 rings and 9 atoms
30 chemicals on CompoundList share this ring system.
- Rings
- 2
- Scaffold atoms
- 9
- Chemicals
- 30
- With full pages
- 5
Scaffold SMILES
C1=CC2CCCC2CO1
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 30 of 30 chemicals
Nardostachin
CAS 114687-82-0C20H32O6
(+)-Iridodial lactol
CAS 183071-73-0C10H16O2
Cyclopenta(c)pyran-4,7-dimethanol, 1,4a,5,6,7,7a-hexahydro-1,6-dihydroxy-, 1-isovalerate
CAS 76319-15-8C15H24O6
![Cyclopenta[c]pyran-1-ol, 1,4a,5,6,7,7a-hexahydro-4,7-dimethyl- chemical structure, C10H16O2, CAS 141271-22-9](/s/OJGPEAXUHQRLNC-UHFFFAOYSA-N.svg)
Cyclopenta[c]pyran-1-ol, 1,4a,5,6,7,7a-hexahydro-4,7-dimethyl-
CAS 141271-22-9C10H16O2
Gyrinidone
CAS 39013-24-6C14H20O3
Loganetin
CAS 29748-10-5C11H16O5
cis-trans-Nepetalactol
CAS 109215-55-6C10H16O2
7-Deoxy-10-hydroxyloganetin
CAS 76267-48-6C11H16O5
Didrovaltrate acetoxy hydrin
CAS 81659-07-6C24H36O10
Chlorovaltrate K
CAS 96801-92-2C22H33ClO8
1,6,8-Trideoxyshanzhigenin
CAS 99173-00-9C10H14O3
7-Deoxyloganetic acid
CAS 120574-63-2C10H14O4
![Methyl 1,7-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate chemical structure, C11H16O5, CAS 73159-48-5](/s/MQIAEBGVYNLDCT-UHFFFAOYSA-N.svg)
Methyl 1,7-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate
CAS 73159-48-5C11H16O5
Jatamanvaltrate E
CAS 1134138-72-9C28H44O12
Jatamanvaltrate G
CAS 1134138-74-1C22H34O9
Jatamanvaltrate C
CAS 1134138-68-3C29H44O13
Jatamanvaltrate F
CAS 1133442-72-4C29H44O12
Jatamanvaltrate H
CAS 1134138-76-3C22H34O9
Jatamanvaltrate A
CAS 1134138-64-9C34H52O15
Jatamanvaltrate B
CAS 1134138-66-1C32H50O13
Valeriotetrate A
CAS 904891-20-9C37H58O15
Volvaltrate B
CAS 1181224-13-4C27H41ClO11
Valeriotriate B
C27H42O12
(4aS,7R,7aR)-1-Methoxy-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta(c)pyran
CAS 19479-28-8C11H18O2
- Butanoic acid, 3-methyl-, 4-[(acetyloxy)methyl]-1,4a,5,6,7,7a-hexahydro-7-methylcyclopenta[c]pyran-1-yl ester, [1S-(1alpha,4aalpha,7alpha,7aalpha)]-162232-32-8C17H26O5
- Valeriotriate B862255-64-9C27H42O12
- (+)-Cis,cis-nepetalactol185399-79-5C10H16O2
- (4AS,7aS)-methyl 1-((tert-butyldimethylsilyl)oxy)-7-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate1951430-56-0C17H30O5Si
- Valeriotriate BC27H42O12
- Heterophdoid A2756016-53-0C26H42O10
Related scaffolds
Same ring framework with different atoms or bond orders
![Scaffold c1ccc2[nH]ccc2c1](/scaffold/SIKJAQJRHWYJAI-UHFFFAOYSA-N/structure.svg)
c1ccc2[nH]ccc2c12,455 chemicals![Scaffold c1ccc2[nH]cnc2c1](/scaffold/HYZJCKYKOHLVJF-UHFFFAOYSA-N/structure.svg)
c1ccc2[nH]cnc2c11,206 chemicals![Scaffold c1ccc2[nH]ncc2c1](/scaffold/BAXOFTOLAUCFNW-UHFFFAOYSA-N/structure.svg)
c1ccc2[nH]ncc2c1795 chemicals
c1ccc2scnc2c1756 chemicals
c1ccc2occc2c1632 chemicals
c1ccc2c(c1)CCC2621 chemicals
c1ccc2c(c1)OCO2536 chemicals
c1ccc2sccc2c1529 chemicals
c1ccn2ccnc2c1525 chemicals
c1ccc2c(c1)CCN2440 chemicals![Scaffold O=c1[nH]c(=O)c2[nH]cnc2[nH]1](/scaffold/LRFVTYWOQMYALW-UHFFFAOYSA-N/structure.svg)
O=c1[nH]c(=O)c2[nH]cnc2[nH]1411 chemicals
O=C1NC(=O)c2ccccc21352 chemicals