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Murcko scaffold

2H-1,5-Benzodioxepin-3(4H)-one scaffold

8 chemicals on CompoundList share this ring system.

Rings: 2
Scaffold atoms: 12
Chemicals: 8
With full pages: 5

Scaffold SMILES

O=C1COc2ccccc2OC1

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 Open the 2H-1,5-Benzodioxepin-3(4H)-one page

Murcko scaffold O=C1COc2ccccc2OC1

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 8 of 8 chemicals

Methyl benzodioxepinone chemical structure, C10H10O3, CAS 28940-11-6

Methyl benzodioxepinone

CAS 28940-11-6C₁₀H₁₀O₃

2H-1,5-Benzodioxepin-3(4H)-one, 7-(3-methylbutyl)- chemical structure, C14H18O3, CAS 362467-67-2

2H-1,5-Benzodioxepin-3(4H)-one, 7-(3-methylbutyl)-

CAS 362467-67-2C₁₄H₁₈O₃

2H-1,5-Benzodioxepin-3(4H)-one chemical structure, C9H8O3, CAS 27612-17-5

2H-1,5-Benzodioxepin-3(4H)-one

CAS 27612-17-5C₉H₈O₃

Methyl 7-methyl-3-oxo-3,4-dihydro-2H-1,5-benzodioxepine-2-carboxylate chemical structure, C12H12O5, CAS 28940-12-7

Methyl 7-methyl-3-oxo-3,4-dihydro-2H-1,5-benzodioxepine-2-carboxylate

CAS 28940-12-7C₁₂H₁₂O₅

7-tert-Butyl-1,5-benzodioxepin-3-one chemical structure, C13H16O3, CAS 195251-91-3

7-tert-Butyl-1,5-benzodioxepin-3-one

CAS 195251-91-3C₁₃H₁₆O₃

2H-1,5-Benzodioxepin-3(4H)-one, 7-propyl- chemical structure, C12H14O3, CAS 207228-93-1

2H-1,5-Benzodioxepin-3(4H)-one, 7-propyl-

CAS 207228-93-1C₁₂H₁₄O₃

2H-1,5-Benzodioxepin-3(4H)-one, 7-(1-methylethyl)- chemical structure, C12H14O3, CAS 950919-28-5

2H-1,5-Benzodioxepin-3(4H)-one, 7-(1-methylethyl)-

CAS 950919-28-5C₁₂H₁₄O₃

7-Bromo-2H-1,5-benzodioxepin-3(4H)-one chemical structure, C9H7BrO3, CAS 1402599-55-6

7-Bromo-2H-1,5-benzodioxepin-3(4H)-one

CAS 1402599-55-6C₉H₇BrO₃