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Murcko scaffold

Ring system with 8 rings and 40 atoms

8 chemicals on CompoundList share this ring system.

Rings
8
Scaffold atoms
40
Chemicals
8
With full pages
1
Scaffold SMILES

C=C1CCC2(CC3C(CC4C3CCC3C4CC=C4CCCC(OC5OCCCC5OC5CCCCO5)C43)O2)OC1

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 C=C1CCC2(CC3C(CC4C3CCC3C4CC=C4CCCC(OC5OCCCC5OC5CCCCO5)C43)O2)OC1

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 8 of 8 chemicals

Desglucoruscin chemical structure, C38H58O12
Desglucoruscin
C38H58O12
Draconin A chemical structure, C44H64O17, CAS 565205-14-3
Draconin A
CAS 565205-14-3C44H64O17
Draconin B chemical structure, C42H62O16, CAS 565205-16-5
Draconin B
CAS 565205-16-5C42H62O16
Draconin C chemical structure, C40H60O15, CAS 565205-17-6
Draconin C
CAS 565205-17-6C40H60O15
Desglucoruscin chemical structure, C38H58O12
Desglucoruscin
C38H58O12
Desglucoruscin chemical structure, C38H58O12, CAS 39491-37-7
Desglucoruscin
CAS 39491-37-7C38H58O12
(2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5S)-4,5-Dihydroxy-2-[(1S,2S,4S,7S,8R,9S,12S,13R,14R,16R)-16-hydroxy-7,9,13-trimethyl-5'-methylidenespiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-14-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol chemical structure, C38H58O12
(2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5S)-4,5-Dihydroxy-2-[(1S,2S,4S,7S,8R,9S,12S,13R,14R,16R)-16-hydroxy-7,9,13-trimethyl-5'-methylidenespiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-14-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
C38H58O12
Ruscoponticoside C chemical structure, C38H58O12
Ruscoponticoside C
C38H58O12