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Murcko scaffold

Ring system with 3 rings and 23 atoms

10 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
23
Chemicals
10
With full pages
2
Scaffold SMILES

O=C(CCc1ccccc1)c1ccc(OC2CCCCO2)cc1

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=C(CCc1ccccc1)c1ccc(OC2CCCCO2)cc1

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 10 of 10 chemicals

beta-D-Glucopyranoside, 3,5-dihydroxy-4-(3-(3-hydroxy-4-methoxyphenyl)-1-oxopropyl)phenyl chemical structure, C22H26O11, CAS 21940-36-3
beta-D-Glucopyranoside, 3,5-dihydroxy-4-(3-(3-hydroxy-4-methoxyphenyl)-1-oxopropyl)phenyl
CAS 21940-36-3C22H26O11
Trilobatin chemical structure, C21H24O10, CAS 4192-90-9
Trilobatin
CAS 4192-90-9C21H24O10
Phloretin 2'-O-(2''-O-acetylglucoside) chemical structure, C23H26O11, CAS 647853-82-5
Phloretin 2'-O-(2''-O-acetylglucoside)
CAS 647853-82-5C23H26O11
Confusoside chemical structure, C21H24O9, CAS 21562-22-1
Confusoside
CAS 21562-22-1C21H24O9
Sieboldin chemical structure, C21H24O11, CAS 18777-73-6
Sieboldin
CAS 18777-73-6C21H24O11
3-(3,4-Dihydroxyphenyl)-1-[2,6-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]propan-1-one chemical structure, C21H24O11
3-(3,4-Dihydroxyphenyl)-1-[2,6-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]propan-1-one
C21H24O11
4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin chemical structure, C29H31NO15, CAS 82628-87-3
4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin
CAS 82628-87-3C29H31NO15
1-Propanone, 1-[4-(beta-D-glucopyranosyloxy)-2,6-dihydroxyphenyl]-3-phenyl- chemical structure, C21H24O9, CAS 73519-16-1
1-Propanone, 1-[4-(beta-D-glucopyranosyloxy)-2,6-dihydroxyphenyl]-3-phenyl-
CAS 73519-16-1C21H24O9
Bauhiniaside B chemical structure, C22H26O9, CAS 69261-84-3
Bauhiniaside B
CAS 69261-84-3C22H26O9
3-(3,4-Dihydroxyphenyl)-1-[2,6-dihydroxy-4-[(3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]propan-1-one chemical structure, C21H24O11
3-(3,4-Dihydroxyphenyl)-1-[2,6-dihydroxy-4-[(3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]propan-1-one
C21H24O11