CompoundList
Sign in
Murcko scaffold

Ring system with 5 rings and 32 atoms

41 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
32
Chemicals
41
With full pages
10
Scaffold SMILES

O=c1cc(-c2ccccc2)oc2cc(OC3CCCC(COC4CCCCO4)O3)ccc12

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=c1cc(-c2ccccc2)oc2cc(OC3CCCC(COC4CCCCO4)O3)ccc12

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 41 of 41 chemicals

Pectolinarin chemical structure, C29H34O15, CAS 28978-02-1
Pectolinarin
CAS 28978-02-1C29H34O15
Diotul chemical structure, C28H32O39S8, CAS 124779-75-5
Diotul
CAS 124779-75-5C28H32O39S8
7-((6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-5-(2-hydroxyethoxy)-2-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one chemical structure, C30H36O16, CAS 115960-14-0
7-((6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-5-(2-hydroxyethoxy)-2-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one
CAS 115960-14-0C30H36O16
Diosmin chemical structure, C28H32O15, CAS 520-27-4
Diosmin
CAS 520-27-4C28H32O15
Linarin chemical structure, C28H32O14, CAS 480-36-4
Linarin
CAS 480-36-4C28H32O14
Scutellarein 7-rutinoside chemical structure, C27H30O15, CAS 36285-12-8
Scutellarein 7-rutinoside
CAS 36285-12-8C27H30O15
Palustroside chemical structure, C27H30O15, CAS 26931-72-6
Palustroside
CAS 26931-72-6C27H30O15
Tamarixetin 7-rutinoside chemical structure, C28H32O16, CAS 14265-53-3
Tamarixetin 7-rutinoside
CAS 14265-53-3C28H32O16
3',4',5,7-Tetrahydroxy-3-methoxyflavone-7-O-alpha-L-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside chemical structure, C28H32O16, CAS 125206-11-3
3',4',5,7-Tetrahydroxy-3-methoxyflavone-7-O-alpha-L-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside
CAS 125206-11-3C28H32O16
SpecPlus_000298 chemical structure, C29H34O15, CAS 134-33-8
SpecPlus_000298
CAS 134-33-8C29H34O15
Isorhoifolin chemical structure, C27H30O14, CAS 552-57-8
Isorhoifolin
CAS 552-57-8C27H30O14
Baicalein 7-O-diglucoside chemical structure, C27H30O15, CAS 114482-86-9
Baicalein 7-O-diglucoside
CAS 114482-86-9C27H30O15
Scolymoside chemical structure, C27H30O15, CAS 20633-84-5
Scolymoside
CAS 20633-84-5C27H30O15
Caesiosid chemical structure, C26H28O15, CAS 19870-44-1
Caesiosid
CAS 19870-44-1C26H28O15
Luteolin 7-arabinopyranosyl-(1->6)-glucoside chemical structure, C26H28O15, CAS 52714-82-6
Luteolin 7-arabinopyranosyl-(1->6)-glucoside
CAS 52714-82-6C26H28O15
7-((6-O-(6-Deoxy-alpha-L-mannopyranosyl)-alpha-D-glucopyranosyl)oxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one chemical structure, C27H30O14, CAS 52438-15-0
7-((6-O-(6-Deoxy-alpha-L-mannopyranosyl)-alpha-D-glucopyranosyl)oxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
CAS 52438-15-0C27H30O14
Luteolin 7-gentiobioside chemical structure, C27H30O16, CAS 70855-41-3
Luteolin 7-gentiobioside
CAS 70855-41-3C27H30O16
Chrysoeriol 7-rutinoside chemical structure, C28H32O15, CAS 32061-83-9
Chrysoeriol 7-rutinoside
CAS 32061-83-9C28H32O15
Linarin 4'''-acetate chemical structure, C30H34O15, CAS 79541-06-3
Linarin 4'''-acetate
CAS 79541-06-3C30H34O15
5-(Acetyloxy)-2-[3-(acetyloxy)-4-methoxyphenyl]-7-[[6-O-(6-deoxy-I+/--L-mannopyranosyl)-I(2)-D-glucopyranosyl]oxy]-4H-1-benzopyran-4-one chemical structure, C32H36O17, CAS 57408-39-6
5-(Acetyloxy)-2-[3-(acetyloxy)-4-methoxyphenyl]-7-[[6-O-(6-deoxy-I+/--L-mannopyranosyl)-I(2)-D-glucopyranosyl]oxy]-4H-1-benzopyran-4-one
CAS 57408-39-6C32H36O17
Isokaempferide 7-rutinoside chemical structure, C28H32O15, CAS 18467-06-6
Isokaempferide 7-rutinoside
CAS 18467-06-6C28H32O15
7-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-5-hydroxy-2-(3,4,5-trimethoxyphenyl)-4H-1-benzopyran-4-one chemical structure, C30H36O16, CAS 289915-88-4
7-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-5-hydroxy-2-(3,4,5-trimethoxyphenyl)-4H-1-benzopyran-4-one
CAS 289915-88-4C30H36O16
6-Iodo diosmin chemical structure, C28H31IO15, CAS 1431536-92-3
6-Iodo diosmin
CAS 1431536-92-3C28H31IO15
Chrysoeriol 7-O-gentiobioside chemical structure, C28H32O16, CAS 75243-34-4
Chrysoeriol 7-O-gentiobioside
CAS 75243-34-4C28H32O16