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Murcko scaffold

Ring system with 4 rings and 22 atoms

11 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
22
Chemicals
11
With full pages
4
Scaffold SMILES

c1ccc2c(c1)CC(c1ccc(OC3CCCCO3)cc1)O2

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 c1ccc2c(c1)CC(c1ccc(OC3CCCCO3)cc1)O2

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 11 of 11 chemicals

RefChem:1049896 chemical structure, C26H32O11, CAS 107870-88-2
RefChem:1049896
CAS 107870-88-2C26H32O11
(2S,3R,4R,5R,6S)-2-[4-[3-(Hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol chemical structure, C26H34O10, CAS 97055-94-2
(2S,3R,4R,5R,6S)-2-[4-[3-(Hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol
CAS 97055-94-2C26H34O10
(7S,8R)-Urolignoside chemical structure, C26H34O11, CAS 131723-83-6
(7S,8R)-Urolignoside
CAS 131723-83-6C26H34O11
Icariside E4 chemical structure, C26H34O10, CAS 126253-42-7
Icariside E4
CAS 126253-42-7C26H34O10
4-[(2R,3S)-2,3-Dihydro-3-(hydroxymethyl)-5-[(1E)-3-hydroxy-1-propen-1-yl]-7-methoxy-2-benzofuranyl]-2-methoxyphenyl I(2)-D-glucopyranoside chemical structure, C26H32O11, CAS 107870-87-1
4-[(2R,3S)-2,3-Dihydro-3-(hydroxymethyl)-5-[(1E)-3-hydroxy-1-propen-1-yl]-7-methoxy-2-benzofuranyl]-2-methoxyphenyl I(2)-D-glucopyranoside
CAS 107870-87-1C26H32O11
Massonianoside B chemical structure, C25H32O10, CAS 188300-19-8
Massonianoside B
CAS 188300-19-8C25H32O10
Massonianoside D chemical structure, C25H32O11, CAS 85115-04-4
Massonianoside D
CAS 85115-04-4C25H32O11
Aegineoside chemical structure, C26H30O12, CAS 752209-48-6
Aegineoside
CAS 752209-48-6C26H30O12
4-[(2R,3S)-2,3-Dihydro-3-(hydroxymethyl)-5-[(1E)-3-hydroxy-1-propen-1-yl]-7-methoxy-2-benzofuranyl]-2,6-dimethoxyphenyl beta-D-glucopyranoside chemical structure, C27H34O12
4-[(2R,3S)-2,3-Dihydro-3-(hydroxymethyl)-5-[(1E)-3-hydroxy-1-propen-1-yl]-7-methoxy-2-benzofuranyl]-2,6-dimethoxyphenyl beta-D-glucopyranoside
C27H34O12
4-[(2R,3S)-2,3-Dihydro-3-(hydroxymethyl)-5-[(1E)-3-hydroxy-1-propen-1-yl]-7-methoxy-2-benzofuranyl]-2,6-dimethoxyphenyl I(2)-D-glucopyranoside chemical structure, C27H34O12, CAS 217650-81-2
4-[(2R,3S)-2,3-Dihydro-3-(hydroxymethyl)-5-[(1E)-3-hydroxy-1-propen-1-yl]-7-methoxy-2-benzofuranyl]-2,6-dimethoxyphenyl I(2)-D-glucopyranoside
CAS 217650-81-2C27H34O12
Orb3179836 chemical structure, C26H34O13, CAS 1931100-79-6
Orb3179836
CAS 1931100-79-6C26H34O13