CompoundList
Sign in
Murcko scaffold

Ring system with 4 rings and 23 atoms

24 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
23
Chemicals
24
With full pages
9
Scaffold SMILES

O=C1c2ccccc2C(=O)c2cc(OC3CCCCO3)ccc21

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 O=C1c2ccccc2C(=O)c2cc(OC3CCCCO3)ccc21

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 24 of 24 chemicals

Frangulin chemical structure, C21H20O9, CAS 60529-33-1
Frangulin
CAS 60529-33-1C21H20O9
1,3,6-Tmaqag chemical structure, C23H22O11, CAS 132367-98-7
1,3,6-Tmaqag
CAS 132367-98-7C23H22O11
Frangulin A chemical structure, C21H20O9, CAS 521-62-0
Frangulin A
CAS 521-62-0C21H20O9
3-(beta-D-Glucopyranosyloxy)-1,7-dihydroxy-2,8-dimethoxy-6-methyl-9,10-anthracenedione chemical structure, C23H24O12, CAS 129025-96-3
3-(beta-D-Glucopyranosyloxy)-1,7-dihydroxy-2,8-dimethoxy-6-methyl-9,10-anthracenedione
CAS 129025-96-3C23H24O12
2-(beta-D-Glucopyranosyloxy)-1,6,7,8-tetramethoxy-3-methyl-9,10-anthracenedione chemical structure, C25H28O12, CAS 96820-54-1
2-(beta-D-Glucopyranosyloxy)-1,6,7,8-tetramethoxy-3-methyl-9,10-anthracenedione
CAS 96820-54-1C25H28O12
Gluco-obtusifolin chemical structure, C22H22O10, CAS 120163-18-0
Gluco-obtusifolin
CAS 120163-18-0C22H22O10
Clicoemodin chemical structure, C21H20O10
Clicoemodin
C21H20O10
1,8-Dihydroxy-3-methyl-6-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxyanthracene-9,10-dione chemical structure, C21H20O10, CAS 34298-85-6
1,8-Dihydroxy-3-methyl-6-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxyanthracene-9,10-dione
CAS 34298-85-6C21H20O10
2-(beta-D-Glucopyranosyloxy)-1-hydroxy-9,10-anthracenedione chemical structure, C20H18O9, CAS 31297-82-2
2-(beta-D-Glucopyranosyloxy)-1-hydroxy-9,10-anthracenedione
CAS 31297-82-2C20H18O9
3-(beta-D-Glucopyranosyloxy)-1,6-dihydroxy-2-methyl-9,10-anthracenedione chemical structure, C21H20O10, CAS 125906-49-2
3-(beta-D-Glucopyranosyloxy)-1,6-dihydroxy-2-methyl-9,10-anthracenedione
CAS 125906-49-2C21H20O10
Glucoemodin chemical structure, C21H20O10
Glucoemodin
C21H20O10
Alizarin-2-beta-D-galactopyranoside chemical structure, C20H18O9, CAS 288262-81-7
Alizarin-2-beta-D-galactopyranoside
CAS 288262-81-7C20H18O9
2'-O-Acetylfrangulin A chemical structure, C23H22O10, CAS 167696-55-1
2'-O-Acetylfrangulin A
CAS 167696-55-1C23H22O10
2-Alizarin glucoside tetraacetate chemical structure, C28H26O13, CAS 60197-67-3
2-Alizarin glucoside tetraacetate
CAS 60197-67-3C28H26O13
1,3,6-Trihydroxy-2-hydroxymethyl-9,10-anthraquinone-3-O-(6'-O-acetyl)-beta-D-glucopyranoside chemical structure, C23H22O12, CAS 1338589-00-6
1,3,6-Trihydroxy-2-hydroxymethyl-9,10-anthraquinone-3-O-(6'-O-acetyl)-beta-D-glucopyranoside
CAS 1338589-00-6C23H22O12
Lucidin 3-O-glucoside chemical structure, C21H20O10, CAS 22255-29-4
Lucidin 3-O-glucoside
CAS 22255-29-4C21H20O10
2-Gluco-aurantioobtusin chemical structure, C23H24O12, CAS 439086-30-3
2-Gluco-aurantioobtusin
CAS 439086-30-3C23H24O12
Ptp1B-IN-21 chemical structure, C22H22O11, CAS 3001295-85-5
Ptp1B-IN-21
CAS 3001295-85-5C22H22O11
Gluco-obtusin chemical structure, C24H26O12, CAS 960135-79-9
Gluco-obtusin
CAS 960135-79-9C24H26O12
1-Desmethylaurantioobtusin 2-O-beta-D-glucopyranoside chemical structure, C22H22O12, CAS 1159837-88-3
1-Desmethylaurantioobtusin 2-O-beta-D-glucopyranoside
CAS 1159837-88-3C22H22O12
1-Desmethylchrysoobtusin-2-O-beta-D-glucoside chemical structure, C24H26O12, CAS 182620-72-0
1-Desmethylchrysoobtusin-2-O-beta-D-glucoside
CAS 182620-72-0C24H26O12
2-O-beta-D-Glucopyranosyloxy-1,7,8-trimethoxy-3-methylanthraquinone chemical structure, C24H26O11, CAS 1622982-60-8
2-O-beta-D-Glucopyranosyloxy-1,7,8-trimethoxy-3-methylanthraquinone
CAS 1622982-60-8C24H26O11
2-Methoxy aurantio-obtusin beta-D-glucoside chemical structure, C24H26O12, CAS 1622982-62-0
2-Methoxy aurantio-obtusin beta-D-glucoside
CAS 1622982-62-0C24H26O12
1-Hydroxy-8-methoxy-3-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracene-9,10-dione chemical structure, C22H22O10, CAS 1341128-49-1
1-Hydroxy-8-methoxy-3-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracene-9,10-dione
CAS 1341128-49-1C22H22O10