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Murcko scaffold

Ring system with 3 rings and 25 atoms

9 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
25
Chemicals
9
With full pages
1
Scaffold SMILES

O=C(OCC1CC=CC(OC(=O)c2ccccc2)C1)c1ccccc1

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(OCC1CC=CC(OC(=O)c2ccccc2)C1)c1ccccc1

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 9 of 9 chemicals

Zeylenol chemical structure, C21H20O7, CAS 78804-17-8
Zeylenol
CAS 78804-17-8C21H20O7
5-Cyclohexene-1,2,3,4-tetrol, 2-[(benzoyloxy)methyl]-, 4-benzoate, (1R,2S,3R,4S)- chemical structure, C21H20O7, CAS 113532-12-0
5-Cyclohexene-1,2,3,4-tetrol, 2-[(benzoyloxy)methyl]-, 4-benzoate, (1R,2S,3R,4S)-
CAS 113532-12-0C21H20O7
Uvarigranol C chemical structure, C23H24O7, CAS 172104-04-0
Uvarigranol C
CAS 172104-04-0C23H24O7
(1S,6alpha)-1-(Benzoyloxy)methyl-6-chloro-4-cyclohexene-1beta,2beta,3alpha-triol 3-benzoate chemical structure, C21H19ClO6, CAS 29228-15-7
(1S,6alpha)-1-(Benzoyloxy)methyl-6-chloro-4-cyclohexene-1beta,2beta,3alpha-triol 3-benzoate
CAS 29228-15-7C21H19ClO6
(5-Benzoyloxy-2-ethoxy-1,6-dihydroxycyclohex-3-en-1-yl)methyl benzoate chemical structure, C23H24O7
(5-Benzoyloxy-2-ethoxy-1,6-dihydroxycyclohex-3-en-1-yl)methyl benzoate
C23H24O7
(1R,4S,5S,6S)-5-[(Benzoyloxy)methyl]-4,5,6-trihydroxycyclohex-2-en-1-yl benzoate chemical structure, C21H20O7, CAS 92620-04-7
(1R,4S,5S,6S)-5-[(Benzoyloxy)methyl]-4,5,6-trihydroxycyclohex-2-en-1-yl benzoate
CAS 92620-04-7C21H20O7
Pipoxide chlorohydrin chemical structure, C21H19ClO6
Pipoxide chlorohydrin
C21H19ClO6
[(1S,2S,5R,6S)-5-Benzoyloxy-2-ethoxy-1,6-dihydroxycyclohex-3-en-1-yl]methyl benzoate chemical structure, C23H24O7, CAS 287194-67-6
[(1S,2S,5R,6S)-5-Benzoyloxy-2-ethoxy-1,6-dihydroxycyclohex-3-en-1-yl]methyl benzoate
CAS 287194-67-6C23H24O7
Uvarigranol B chemical structure, C23H22O8, CAS 164204-79-9
Uvarigranol B
CAS 164204-79-9C23H22O8