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Murcko scaffold

Ring system with 2 rings and 44 atoms

7 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
44
Chemicals
7
With full pages
1
Scaffold SMILES

O=C1C=CC=CC=CCC=CCC(=O)OC(CCCC(=O)C=CC=CC=CCCOC2CCCCO2)CC=CC=CC=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 O=C1C=CC=CC=CCC=CCC(=O)OC(CCCC(=O)C=CC=CC=CCCOC2CCCCO2)CC=CC=CC=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 7 of 7 chemicals

Antibiotic 1063Z chemical structure, C47H66O13
Antibiotic 1063Z
C47H66O13
Pulvomycin chemical structure, C47H66O13, CAS 11006-66-9
Pulvomycin
CAS 11006-66-9C47H66O13
Labilomycin chemical structure, C47H66O13
Labilomycin
C47H66O13
(4E,7E,9E,11E,15E,17E,19E)-22-[(6E,8E,10E)-3,12-Dihydroxy-13-[(2R,3R,4S,5R,6R)-4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl]oxy-4-methyl-5-oxotetradeca-6,8,10-trien-2-yl]-6,14-dihydroxy-5,8,12-trimethyl-1-oxacyclodocosa-4,7,9,11,15,17,19-heptaene-2,13-dione chemical structure, C47H66O13
(4E,7E,9E,11E,15E,17E,19E)-22-[(6E,8E,10E)-3,12-Dihydroxy-13-[(2R,3R,4S,5R,6R)-4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl]oxy-4-methyl-5-oxotetradeca-6,8,10-trien-2-yl]-6,14-dihydroxy-5,8,12-trimethyl-1-oxacyclodocosa-4,7,9,11,15,17,19-heptaene-2,13-dione
C47H66O13
(4Z,7Z,9Z,11Z,15Z,17Z,19Z)-22-[(6E,8E,10E)-3,12-Dihydroxy-13-[(2R,3R,4S,5R,6R)-4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl]oxy-4-methyl-5-oxotetradeca-6,8,10-trien-2-yl]-6,14-dihydroxy-5,8,12-trimethyl-1-oxacyclodocosa-4,7,9,11,15,17,19-heptaene-2,13-dione chemical structure, C47H66O13
(4Z,7Z,9Z,11Z,15Z,17Z,19Z)-22-[(6E,8E,10E)-3,12-Dihydroxy-13-[(2R,3R,4S,5R,6R)-4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl]oxy-4-methyl-5-oxotetradeca-6,8,10-trien-2-yl]-6,14-dihydroxy-5,8,12-trimethyl-1-oxacyclodocosa-4,7,9,11,15,17,19-heptaene-2,13-dione
C47H66O13
(4E,7E,9Z,11E,15E,17E,19Z)-22-[(6E,8E,10E)-3,12-Dihydroxy-13-[(2R,3R,4S,5R,6R)-4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl]oxy-4-methyl-5-oxotetradeca-6,8,10-trien-2-yl]-6,14-dihydroxy-5,8,12-trimethyl-1-oxacyclodocosa-4,7,9,11,15,17,19-heptaene-2,13-dione chemical structure, C47H66O13
(4E,7E,9Z,11E,15E,17E,19Z)-22-[(6E,8E,10E)-3,12-Dihydroxy-13-[(2R,3R,4S,5R,6R)-4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl]oxy-4-methyl-5-oxotetradeca-6,8,10-trien-2-yl]-6,14-dihydroxy-5,8,12-trimethyl-1-oxacyclodocosa-4,7,9,11,15,17,19-heptaene-2,13-dione
C47H66O13
Orb1701756 chemical structure, C47H66O13
Orb1701756
C47H66O13