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Murcko scaffold

Ring system with 5 rings and 29 atoms

14 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
29
Chemicals
14
With full pages
1
Scaffold SMILES

O=C1CC2CC3Cc4ccccc4C=C3C(=O)C2C=C1C(=O)NCN1CCCC1

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=C1CC2CC3Cc4ccccc4C=C3C(=O)C2C=C1C(=O)NCN1CCCC1

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 14 of 14 chemicals

Rolitetracycline chemical structure, C27H33N3O8, CAS 751-97-3
Rolitetracycline
CAS 751-97-3C27H33N3O8
Rolitetracycline nitrate hydrate chemical structure, C54H74N8O25, CAS 26657-13-6
Rolitetracycline nitrate hydrate
CAS 26657-13-6C54H74N8O25
Prolinomethyltetracycline chemical structure, C28H33N3O10
Prolinomethyltetracycline
C28H33N3O10
Rolitetracycline nitrate chemical structure, C27H34N4O11, CAS 20685-78-3
Rolitetracycline nitrate
CAS 20685-78-3C27H34N4O11
Acetic acid--1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-N-[(pyrrolidin-1-yl)methyl]-3,4,4a,5,5a,6,12,12a-octahydrotetracene-2-carboxamide (1/1) chemical structure, C27H32N2O10, CAS 7144-59-4
Acetic acid--1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-N-[(pyrrolidin-1-yl)methyl]-3,4,4a,5,5a,6,12,12a-octahydrotetracene-2-carboxamide (1/1)
CAS 7144-59-4C27H32N2O10
Solvocillin chemical structure, C27H34ClN3O8
Solvocillin
C27H34ClN3O8
Pyrrolidinylmethyltetracycline hydrochloride chemical structure, C27H34ClN3O8
Pyrrolidinylmethyltetracycline hydrochloride
C27H34ClN3O8
Rolitetracycline hydrochloride chemical structure, C27H34ClN3O8, CAS 68060-64-0
Rolitetracycline hydrochloride
CAS 68060-64-0C27H34ClN3O8
Pyrrolidinomethyldoxycycline chemical structure, C27H33N3O8, CAS 27639-12-9
Pyrrolidinomethyldoxycycline
CAS 27639-12-9C27H33N3O8
1-[[[4-(Dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carbonyl]amino]methyl]pyrrolidine-2-carboxylic acid chemical structure, C28H33N3O10, CAS 37106-99-3
1-[[[4-(Dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carbonyl]amino]methyl]pyrrolidine-2-carboxylic acid
CAS 37106-99-3C28H33N3O10
Tecaf chemical structure, C42H49Cl2N5O16, CAS 4154-10-3
Tecaf
CAS 4154-10-3C42H49Cl2N5O16
Prolinomethyltetracycline chemical structure, C28H33N3O10
Prolinomethyltetracycline
C28H33N3O10
Pyrrolidinemethyltetracycline guaiacol sulfonate chemical structure, C34H41N3O13S, CAS 35054-80-9
Pyrrolidinemethyltetracycline guaiacol sulfonate
CAS 35054-80-9C34H41N3O13S
(4S,4aR,5S,5aR,6S,12aR)-4-(Dimethylamino)-1,5,6,10,11,12a-hexahydroxy-6-methyl-3,12-dioxo-N-(pyrrolidin-1-ylmethyl)-4,4a,5,5a-tetrahydrotetracene-2-carboxamide chemical structure, C27H33N3O9, CAS 18409-41-1
(4S,4aR,5S,5aR,6S,12aR)-4-(Dimethylamino)-1,5,6,10,11,12a-hexahydroxy-6-methyl-3,12-dioxo-N-(pyrrolidin-1-ylmethyl)-4,4a,5,5a-tetrahydrotetracene-2-carboxamide
CAS 18409-41-1C27H33N3O9