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Murcko scaffold

Ring system with 2 rings and 19 atoms

53 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
19
Chemicals
53
With full pages
17
Scaffold SMILES

O=C(C=Cc1ccccc1)OCCc1ccccc1

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(C=Cc1ccccc1)OCCc1ccccc1

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 48 of 53 chemicals

Phenethyl dimethyl caffeate chemical structure, C19H20O4
Phenethyl dimethyl caffeate
C19H20O4
alpha-((3-(3,4-Dihydroxyphenyl)-1-oxo-2-propen-1-yl)oxy)-3,4-dihydroxybenzenepropanoic acid chemical structure, C18H16O8, CAS 537-15-5
alpha-((3-(3,4-Dihydroxyphenyl)-1-oxo-2-propen-1-yl)oxy)-3,4-dihydroxybenzenepropanoic acid
CAS 537-15-5C18H16O8
Benzenepropanoic acid, alpha-[[(2E)-3-(4-nitrophenyl)-1-oxo-2-propenyl]oxy]-, (alphaS)- chemical structure, C18H15NO6
Benzenepropanoic acid, alpha-[[(2E)-3-(4-nitrophenyl)-1-oxo-2-propenyl]oxy]-, (alphaS)-
C18H15NO6
2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester chemical structure, C17H16O4, CAS 169232-11-5
2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester
CAS 169232-11-5C17H16O4
3,4-Difluorocinnamic acid beta-phenylethyl ester chemical structure, C17H14F2O2, CAS 169232-10-4
3,4-Difluorocinnamic acid beta-phenylethyl ester
CAS 169232-10-4C17H14F2O2
p-Hydroxyphenethyl trans-ferulate chemical structure, C18H18O5, CAS 84873-15-4
p-Hydroxyphenethyl trans-ferulate
CAS 84873-15-4C18H18O5
Caffeic acid 3,4-dihydroxyphenethyl ester chemical structure, C17H16O6, CAS 329685-54-3
Caffeic acid 3,4-dihydroxyphenethyl ester
CAS 329685-54-3C17H16O6
(S)-Rosmarinic acid chemical structure, C18H16O8, CAS 179188-11-5
(S)-Rosmarinic acid
CAS 179188-11-5C18H16O8
Caffeic acid phenethyl ester chemical structure, C17H16O4, CAS 104594-70-9
Caffeic acid phenethyl ester
CAS 104594-70-9C17H16O4
Rosmarinic acid chemical structure, C18H16O8, CAS 20283-92-5
Rosmarinic acid
CAS 20283-92-5C18H16O8
Phenylethyl 3-methylcaffeate chemical structure, C18H18O4, CAS 71835-85-3
Phenylethyl 3-methylcaffeate
CAS 71835-85-3C18H18O4
3-(3,4-Dihydroxyphenyl)-2-((E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl)oxypropanoic acid chemical structure, C18H16O8, CAS 179462-74-9
3-(3,4-Dihydroxyphenyl)-2-((E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl)oxypropanoic acid
CAS 179462-74-9C18H16O8
Caffeic acid dimethyl ether phenethyl ester chemical structure, C19H20O4, CAS 145551-14-0
Caffeic acid dimethyl ether phenethyl ester
CAS 145551-14-0C19H20O4
Phenethyl cinnamate chemical structure, C17H16O2, CAS 63238-64-2
Phenethyl cinnamate
CAS 63238-64-2C17H16O2
(E)-Phenethyl 3-(3-hydroxy-4-methoxyphenyl)acrylate chemical structure, C18H18O4, CAS 117292-80-5
(E)-Phenethyl 3-(3-hydroxy-4-methoxyphenyl)acrylate
CAS 117292-80-5C18H18O4
Phenethyl (E)-3-(2,5-dihydroxyphenyl)prop-2-enoate chemical structure, C17H16O4, CAS 179691-97-5
Phenethyl (E)-3-(2,5-dihydroxyphenyl)prop-2-enoate
CAS 179691-97-5C17H16O4
Benzenepropanoic acid, alpha-(((2E)-3-(4-nitrophenyl)-1-oxo-2-propen-1-yl)oxy)-, (alphaS)- chemical structure, C18H15NO6, CAS 29842-22-6
Benzenepropanoic acid, alpha-(((2E)-3-(4-nitrophenyl)-1-oxo-2-propen-1-yl)oxy)-, (alphaS)-
CAS 29842-22-6C18H15NO6
2-Propenoic acid, 3-phenyl-, 2,3-dihydroxy-2-(4-(hydroxymethyl)-2-(2-methyl-1-oxopropoxy)phenyl)propyl ester, (E)- chemical structure, C23H26O7, CAS 80235-19-4
2-Propenoic acid, 3-phenyl-, 2,3-dihydroxy-2-(4-(hydroxymethyl)-2-(2-methyl-1-oxopropoxy)phenyl)propyl ester, (E)-
CAS 80235-19-4C23H26O7
O-Cinnamoyl beta-phenyllactate chemical structure, C18H16O4, CAS 26467-18-5
O-Cinnamoyl beta-phenyllactate
CAS 26467-18-5C18H16O4
2-Propenoic acid, 3-(4-chlorophenyl)-, 2-(3,4-dichlorophenyl)-5-(dimethylamino)pentyl ester, hydrochloride chemical structure, C22H25Cl4NO2, CAS 119584-95-1
2-Propenoic acid, 3-(4-chlorophenyl)-, 2-(3,4-dichlorophenyl)-5-(dimethylamino)pentyl ester, hydrochloride
CAS 119584-95-1C22H25Cl4NO2
2-Propenoic acid, 3-(4-chlorophenyl)-, 2-(4-bromophenyl)-5-(diethylamino)pentyl ester, hydrochloride chemical structure, C24H30BrCl2NO2, CAS 119585-23-8
2-Propenoic acid, 3-(4-chlorophenyl)-, 2-(4-bromophenyl)-5-(diethylamino)pentyl ester, hydrochloride
CAS 119585-23-8C24H30BrCl2NO2
Methyl rosmarinate chemical structure, C19H18O8, CAS 99353-00-1
Methyl rosmarinate
CAS 99353-00-1C19H18O8
(Z)-3-(3,4-Dihydroxyphenyl)propenoic acid 2-phenylethyl ester chemical structure, C17H16O4, CAS 132336-00-6
(Z)-3-(3,4-Dihydroxyphenyl)propenoic acid 2-phenylethyl ester
CAS 132336-00-6C17H16O4
(E)-3-(3,4-Dihydroxyphenyl)-2-(3-(4-hydroxyphenyl)acryloyloxy)propanoic acid chemical structure, C18H16O7, CAS 179462-76-1
(E)-3-(3,4-Dihydroxyphenyl)-2-(3-(4-hydroxyphenyl)acryloyloxy)propanoic acid
CAS 179462-76-1C18H16O7