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Murcko scaffold

Ring system with 4 rings and 27 atoms

25 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
27
Chemicals
25
With full pages
4
Scaffold SMILES

O=C(Nc1cc2ccc(OC3CCCCO3)cc2oc1=O)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(Nc1cc2ccc(OC3CCCCO3)cc2oc1=O)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 25 of 25 chemicals

Novobiocin sodium chemical structure, C31H35N2NaO11, CAS 1476-53-5
Novobiocin sodium
CAS 1476-53-5C31H35N2NaO11
Novobiocin chemical structure, C31H36N2O11, CAS 303-81-1
Novobiocin
CAS 303-81-1C31H36N2O11
Sodium 4-[(7-{[(2S,3R,4S,5R)-4-(carbamoyloxy)-3-hydroxy-5-methoxy-6,6-dimethyloxan-2-yl]oxy}-4-hydroxy-8-methyl-2-oxo-2H-chromen-3-yl)carbamoyl]-2-(3-methylbut-2-en-1-yl)benzen-1-olate chemical structure, C31H35N2NaO11, CAS 2743427-08-7
Sodium 4-[(7-{[(2S,3R,4S,5R)-4-(carbamoyloxy)-3-hydroxy-5-methoxy-6,6-dimethyloxan-2-yl]oxy}-4-hydroxy-8-methyl-2-oxo-2H-chromen-3-yl)carbamoyl]-2-(3-methylbut-2-en-1-yl)benzen-1-olate
CAS 2743427-08-7C31H35N2NaO11
Desmethyldescarbamoylnovobiocin chemical structure, C29H33NO10, CAS 22427-42-5
Desmethyldescarbamoylnovobiocin
CAS 22427-42-5C29H33NO10
Descarbamoylnovobiocin chemical structure, C30H35NO10, CAS 75057-97-5
Descarbamoylnovobiocin
CAS 75057-97-5C30H35NO10
Descarbamylnovobiocin chemical structure, C30H35NO10, CAS 10544-02-2
Descarbamylnovobiocin
CAS 10544-02-2C30H35NO10
2''-O-Carbamylnovobiocin chemical structure, C32H37N3O12, CAS 138686-58-5
2''-O-Carbamylnovobiocin
CAS 138686-58-5C32H37N3O12
Novobiocin sodium salt chemical structure, C31H35N2NaO11, CAS 1021496-62-7
Novobiocin sodium salt
CAS 1021496-62-7C31H35N2NaO11
Novobiocin calcium chemical structure, C62H70CaN4O22, CAS 4309-70-0
Novobiocin calcium
CAS 4309-70-0C62H70CaN4O22
Novobiocin, dihydro-, sodium salt chemical structure, C31H37N2NaO11, CAS 4627-98-9
Novobiocin, dihydro-, sodium salt
CAS 4627-98-9C31H37N2NaO11
Dihydronovobiocin chemical structure, C31H38N2O11, CAS 29826-16-2
Dihydronovobiocin
CAS 29826-16-2C31H38N2O11
Novobiocin, dihydro-, calcium salt (2:1) chemical structure, C62H74CaN4O22, CAS 4863-55-2
Novobiocin, dihydro-, calcium salt (2:1)
CAS 4863-55-2C62H74CaN4O22
RefChem:401088 chemical structure, C31H38N2O12, CAS 56677-21-5
RefChem:401088
CAS 56677-21-5C31H38N2O12
Albamycin T chemical structure, C53H60N4O19, CAS 8021-84-9
Albamycin T
CAS 8021-84-9C53H60N4O19
Albacillin chemical structure, C47H54N4O15S, CAS 8025-50-1
Albacillin
CAS 8025-50-1C47H54N4O15S
[(3R,4S,5R,6R)-5-Hydroxy-6-[4-hydroxy-3-[[4-hydroxy-3-(3-methylbut-2-enyl)benzoyl]amino]-2-oxochromen-7-yl]oxy-3-methoxy-2,2-dimethyloxan-4-yl] carbamate chemical structure, C30H34N2O11, CAS 107629-96-9
[(3R,4S,5R,6R)-5-Hydroxy-6-[4-hydroxy-3-[[4-hydroxy-3-(3-methylbut-2-enyl)benzoyl]amino]-2-oxochromen-7-yl]oxy-3-methoxy-2,2-dimethyloxan-4-yl] carbamate
CAS 107629-96-9C30H34N2O11
N-[7-[[3-O-(Aminocarbonyl)-6-deoxy-5-C-methyl-4-O-methyl-I+/--L-lyxo-hexopyranosyl]oxy]-4-hydroxy-8-methyl-2-oxo-2H-1-benzopyran-3-yl]-4-methoxy-3-(3-methyl-2-buten-1-yl)benzamide chemical structure, C32H38N2O11, CAS 69298-34-6
N-[7-[[3-O-(Aminocarbonyl)-6-deoxy-5-C-methyl-4-O-methyl-I+/--L-lyxo-hexopyranosyl]oxy]-4-hydroxy-8-methyl-2-oxo-2H-1-benzopyran-3-yl]-4-methoxy-3-(3-methyl-2-buten-1-yl)benzamide
CAS 69298-34-6C32H38N2O11
Novobiocin, monoacetate (ester) chemical structure, C33H38N2O12, CAS 31026-12-7
Novobiocin, monoacetate (ester)
CAS 31026-12-7C33H38N2O12
Novobiocin, 2a(2)a(2),4a(2)-diacetate chemical structure, C35H40N2O13, CAS 122970-77-8
Novobiocin, 2a(2)a(2),4a(2)-diacetate
CAS 122970-77-8C35H40N2O13
Novobiocin, triacetate chemical structure, C37H42N2O14, CAS 121707-96-8
Novobiocin, triacetate
CAS 121707-96-8C37H42N2O14
Novobiocin, methyl- chemical structure, C32H38N2O11, CAS 90229-15-5
Novobiocin, methyl-
CAS 90229-15-5C32H38N2O11
Orb3023906 chemical structure, C31H36N2O12, CAS 69282-87-7
Orb3023906
CAS 69282-87-7C31H36N2O12
N-[7-[[3-O-(Aminocarbonyl)-6-deoxy-5-C-methyl-4-O-methyl-I+/--L-lyxo-hexopyranosyl]oxy]-4-hydroxy-8-methyl-2-oxo-2H-1-benzopyran-3-yl]-4-hydroxy-3-(4-hydroxy-3-methylbutyl)benzamide chemical structure, C31H38N2O12, CAS 89764-08-9
N-[7-[[3-O-(Aminocarbonyl)-6-deoxy-5-C-methyl-4-O-methyl-I+/--L-lyxo-hexopyranosyl]oxy]-4-hydroxy-8-methyl-2-oxo-2H-1-benzopyran-3-yl]-4-hydroxy-3-(4-hydroxy-3-methylbutyl)benzamide
CAS 89764-08-9C31H38N2O12
RefChem:362488 chemical structure, C30H34N2O11, CAS 356546-02-6
RefChem:362488
CAS 356546-02-6C30H34N2O11