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Murcko scaffold

Ring system with 6 rings and 25 atoms

5 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
25
Chemicals
5
With full pages
2
Scaffold SMILES

c1cc2c3c(c1)OC1C(OC4CCCCO4)CCC4C(C2)NCCC341

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 c1cc2c3c(c1)OC1C(OC4CCCCO4)CCC4C(C2)NCCC341

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 5 of 5 chemicals

Dihydromorphine-6-Beta-D-glucuronide chemical structure, C23H29NO9, CAS 70001-26-2
Dihydromorphine-6-Beta-D-glucuronide
CAS 70001-26-2C23H29NO9
(5alpha,6alpha)-3-Hydroxy-4,5-epoxymorphinan-6-yl beta-D-glucopyranosiduronic acid chemical structure, C22H27NO9, CAS 561323-10-2
(5alpha,6alpha)-3-Hydroxy-4,5-epoxymorphinan-6-yl beta-D-glucopyranosiduronic acid
CAS 561323-10-2C22H27NO9
Dihydrocodeine 6-O-?-D-glucuronide chemical structure, C24H31NO9, CAS 88480-40-4
Dihydrocodeine 6-O-?-D-glucuronide
CAS 88480-40-4C24H31NO9
Nor Dihydrocodeine 6-O-beta-D-Glucuronide chemical structure, C23H29NO9, CAS 157287-30-4
Nor Dihydrocodeine 6-O-beta-D-Glucuronide
CAS 157287-30-4C23H29NO9
RefChem:398883 chemical structure, C26H32F3NO11, CAS 1426174-42-6
RefChem:398883
CAS 1426174-42-6C26H32F3NO11