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Murcko scaffold

Ring system with 3 rings and 17 atoms

23 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
17
Chemicals
23
With full pages
4
Scaffold SMILES

c1ccc(CCc2ccc3c(c2)OCO3)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 c1ccc(CCc2ccc3c(c2)OCO3)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 23 of 23 chemicals

1,3-Benzodioxole-5-methanamine, alpha-(phenylmethyl)-, hydrochloride chemical structure, C15H16ClNO2, CAS 6278-55-3
1,3-Benzodioxole-5-methanamine, alpha-(phenylmethyl)-, hydrochloride
CAS 6278-55-3C15H16ClNO2
3-(2H-1,3-Benzodioxol-5-yl)-3-hydroxy-2-phenylpropanoic acid chemical structure, C16H14O5, CAS 5426-82-4
3-(2H-1,3-Benzodioxol-5-yl)-3-hydroxy-2-phenylpropanoic acid
CAS 5426-82-4C16H14O5
1-(1,3-Benzodioxol-5-yl)-2-phenylpropane-1,3-diol chemical structure, C16H16O4, CAS 5426-83-5
1-(1,3-Benzodioxol-5-yl)-2-phenylpropane-1,3-diol
CAS 5426-83-5C16H16O4
1-(1,3-Benzodioxol-5-yl)-2-phenylethyl acetate chemical structure, C17H16O4, CAS 5469-07-8
1-(1,3-Benzodioxol-5-yl)-2-phenylethyl acetate
CAS 5469-07-8C17H16O4
1-(1,3-Benzodioxol-5-yl)-N-methyl-2-phenylethanamine chemical structure, C16H17NO2, CAS 6278-21-3
1-(1,3-Benzodioxol-5-yl)-N-methyl-2-phenylethanamine
CAS 6278-21-3C16H17NO2
Ethyl 3-acetyloxy-3-(1,3-benzodioxol-5-yl)-2-phenylpropanoate chemical structure, C20H20O6, CAS 5442-29-5
Ethyl 3-acetyloxy-3-(1,3-benzodioxol-5-yl)-2-phenylpropanoate
CAS 5442-29-5C20H20O6
5-(2'-(3''-Hydroxy-5''-methoxyphenyl)-ethyl)-1,3-benzodioxole chemical structure, C16H16O4, CAS 303088-44-0
5-(2'-(3''-Hydroxy-5''-methoxyphenyl)-ethyl)-1,3-benzodioxole
CAS 303088-44-0C16H16O4
3-(1,3-Benzodioxol-5-yl)-4-phenylbutanoic acid chemical structure, C17H16O4, CAS 118806-81-8
3-(1,3-Benzodioxol-5-yl)-4-phenylbutanoic acid
CAS 118806-81-8C17H16O4
1,3-Propanediamine, N'-(1,3-benzodioxol-5-yl)-2-phenylethyl-N,N-diethyl- chemical structure, C22H30N2O2, CAS 56208-13-0
1,3-Propanediamine, N'-(1,3-benzodioxol-5-yl)-2-phenylethyl-N,N-diethyl-
CAS 56208-13-0C22H30N2O2
1,3-Benzodioxole-5-methanamine, alpha-(2-phenylethyl)-, hydrochloride chemical structure, C16H18ClNO2, CAS 126520-99-8
1,3-Benzodioxole-5-methanamine, alpha-(2-phenylethyl)-, hydrochloride
CAS 126520-99-8C16H18ClNO2
3-Benzo[1,3]dioxol-5-yl-4-phenyl-butylamine chemical structure, C17H19NO2, CAS 374759-53-2
3-Benzo[1,3]dioxol-5-yl-4-phenyl-butylamine
CAS 374759-53-2C17H19NO2
Pholidotol A chemical structure, C16H16O5, CAS 875534-05-7
Pholidotol A
CAS 875534-05-7C16H16O5
N-[2-(2H-1,3-Benzodioxol-5-yl)-1-phenylethyl]acetamide chemical structure, C17H17NO3, CAS 76306-61-1
N-[2-(2H-1,3-Benzodioxol-5-yl)-1-phenylethyl]acetamide
CAS 76306-61-1C17H17NO3
Methylenedioxymephenidine chemical structure, C16H17NO2, CAS 1350821-28-1
Methylenedioxymephenidine
CAS 1350821-28-1C16H17NO2
3-(2H-1,3-Benzodioxol-5-yl)-3-hydroxy-2-phenylpropanoic acid--silver (1/1) chemical structure, C16H14AgO5, CAS 5450-49-7
3-(2H-1,3-Benzodioxol-5-yl)-3-hydroxy-2-phenylpropanoic acid--silver (1/1)
CAS 5450-49-7C16H14AgO5
2-(2H-1,3-Benzodioxol-5-yl)-1-phenylethan-1-amine--hydrogen chloride (1/1) chemical structure, C15H16ClNO2, CAS 7467-04-1
2-(2H-1,3-Benzodioxol-5-yl)-1-phenylethan-1-amine--hydrogen chloride (1/1)
CAS 7467-04-1C15H16ClNO2
I+/--[[4-(1-Methylethyl)phenyl]methyl]-1,3-benzodioxole-5-methanamine chemical structure, C18H21NO2, CAS 1017185-92-0
I+/--[[4-(1-Methylethyl)phenyl]methyl]-1,3-benzodioxole-5-methanamine
CAS 1017185-92-0C18H21NO2
I(2)-[(4-Chlorophenyl)methyl]-1,3-benzodioxole-5-ethanol chemical structure, C16H15ClO3, CAS 1017427-37-0
I(2)-[(4-Chlorophenyl)methyl]-1,3-benzodioxole-5-ethanol
CAS 1017427-37-0C16H15ClO3
I+/--[(3-Methoxyphenyl)methyl]-1,3-benzodioxole-5-methanol chemical structure, C16H16O4, CAS 1225961-51-2
I+/--[(3-Methoxyphenyl)methyl]-1,3-benzodioxole-5-methanol
CAS 1225961-51-2C16H16O4
1-(1,3-Dioxaindan-5-yl)-2-(4-methoxyphenyl)ethan-1-ol chemical structure, C16H16O4, CAS 1225905-22-5
1-(1,3-Dioxaindan-5-yl)-2-(4-methoxyphenyl)ethan-1-ol
CAS 1225905-22-5C16H16O4
4-[2-(6-Methoxy-2H-1,3-benzodioxol-5-yl)ethyl]benzene-1,3-diol chemical structure, C16H16O5, CAS 105706-17-0
4-[2-(6-Methoxy-2H-1,3-benzodioxol-5-yl)ethyl]benzene-1,3-diol
CAS 105706-17-0C16H16O5
5-[2-(3-Nitrophenyl)ethyl]-2H-1,3-benzodioxole chemical structure, C15H13NO4, CAS 59925-91-6
5-[2-(3-Nitrophenyl)ethyl]-2H-1,3-benzodioxole
CAS 59925-91-6C15H13NO4
alpha-Phenyl-mdma hydrochloride chemical structure, C16H18ClNO2, CAS 1431521-30-0
alpha-Phenyl-mdma hydrochloride
CAS 1431521-30-0C16H18ClNO2