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Murcko scaffold

Ring system with 3 rings and 13 atoms

8 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 13
Chemicals: 8
With full pages: 3

Scaffold SMILES

O=C1c2ccccc2C2NC=CC12

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=C1c2ccccc2C2NC=CC12

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

Eboracin chemical structure, C14H13NO5, CAS 57310-23-3

CAS 57310-23-3C₁₄H₁₃NO₅

(3AS,8BS)-3A,8B-Dihydroxy-2-methyl-4-oxo-1,3A,4,8B-tetrahydroindeno[1,2-B]pyrrole-3-carbonitrile chemical structure, C13H10N2O3, CAS 611187-45-2

(3AS,8BS)-3A,8B-Dihydroxy-2-methyl-4-oxo-1,3A,4,8B-tetrahydroindeno[1,2-B]pyrrole-3-carbonitrile

CAS 611187-45-2C₁₃H₁₀N₂O₃

Ethyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate chemical structure, C15H15NO5, CAS 292855-66-4

Ethyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate

CAS 292855-66-4C₁₅H₁₅NO₅

2-Ethoxyethyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate chemical structure, C17H19NO6, CAS 314051-97-3

2-Ethoxyethyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate

CAS 314051-97-3C₁₇H₁₉NO₆

3a,8b-Dihydroxy-2-methyl-4-oxo-1H,3aH,4H,8bH-indeno[1,2-b]pyrrole-3-carbonitrile chemical structure, C13H10N2O3, CAS 57310-24-4

3a,8b-Dihydroxy-2-methyl-4-oxo-1H,3aH,4H,8bH-indeno[1,2-b]pyrrole-3-carbonitrile

CAS 57310-24-4C₁₃H₁₀N₂O₃

2-(Ethylsulfanyl)ethyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate chemical structure, C17H19NO5S, CAS 312622-74-5

2-(Ethylsulfanyl)ethyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate

CAS 312622-74-5C₁₇H₁₉NO₅S

2-Isopropoxyethyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate chemical structure, C18H21NO6, CAS 312622-72-3

2-Isopropoxyethyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate

CAS 312622-72-3C₁₈H₂₁NO₆

Propyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate chemical structure, C16H17NO5, CAS 301319-83-5

Propyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate

CAS 301319-83-5C₁₆H₁₇NO₅