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Murcko scaffold

Ring system with 3 rings and 21 atoms

32 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
21
Chemicals
32
With full pages
0
Scaffold SMILES

N=C1C=CC(C2CC(OC3CCCCO3)CCO2)CC1=O

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 N=C1C=CC(C2CC(OC3CCCCO3)CCO2)CC1=O

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 32 of 32 chemicals

Antibiotic 273 A2-alpha chemical structure, C39H55N3O20S2, CAS 102326-69-2
Antibiotic 273 A2-alpha
CAS 102326-69-2C39H55N3O20S2
Paulomycin B chemical structure, C33H44N2O17S
Paulomycin B
C33H44N2O17S
Paulomycin A chemical structure, C34H46N2O17S
Paulomycin A
C34H46N2O17S
Orb3024493 chemical structure, C34H46N2O17S
Orb3024493
C34H46N2O17S
Antibiotic 273 A1-alpha chemical structure, C44H64N4O23S3, CAS 101411-70-5
Antibiotic 273 A1-alpha
CAS 101411-70-5C44H64N4O23S3
Volonomycin A chemical structure, C34H46N2O17S, CAS 81988-77-4
Volonomycin A
CAS 81988-77-4C34H46N2O17S
Paldimycin B chemical structure, C43H62N4O23S3, CAS 101411-71-6
Paldimycin B
CAS 101411-71-6C43H62N4O23S3
Paulomycin B chemical structure, C33H44N2O17S, CAS 81988-76-3
Paulomycin B
CAS 81988-76-3C33H44N2O17S
Paulomycin A chemical structure, C34H46N2O17S
Paulomycin A
C34H46N2O17S
Paulomycin chemical structure, C27H34N2O15S, CAS 59794-18-2
Paulomycin
CAS 59794-18-2C27H34N2O15S
Antibiotic 273 A2-beta chemical structure, C38H53N3O20S2, CAS 102301-13-3
Antibiotic 273 A2-beta
CAS 102301-13-3C38H53N3O20S2
Senfolomycin A chemical structure, C29H36N2O16S, CAS 11017-36-0
Senfolomycin A
CAS 11017-36-0C29H36N2O16S
Senfolomycin B chemical structure, C29H38N2O16S, CAS 11031-56-4
Senfolomycin B
CAS 11031-56-4C29H38N2O16S
Paldimycin chemical structure, C87H126N8O46S6, CAS 102426-96-0
Paldimycin
CAS 102426-96-0C87H126N8O46S6
Antibiotic 273 A1-beta chemical structure, C43H62N4O23S3
Antibiotic 273 A1-beta
C43H62N4O23S3
Paldimycin A chemical structure, C44H64N4O23S3
Paldimycin A
C44H64N4O23S3
(3S)-3-[(3R,4S,5R,6R)-6-(Acetyloxymethyl)-3-hydroxy-4-[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyl-5-[(1R)-1-[(2S)-2-methylbutanoyl]oxyethyl]oxan-2-yl]oxy-5-[(E)-2-isothiocyanatobut-2-enoyl]oxyoxan-2-yl]-2,3-dihydroxy-6-imino-5-oxocyclohexene-1-carboxylic acid chemical structure, C34H46N2O17S
(3S)-3-[(3R,4S,5R,6R)-6-(Acetyloxymethyl)-3-hydroxy-4-[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyl-5-[(1R)-1-[(2S)-2-methylbutanoyl]oxyethyl]oxan-2-yl]oxy-5-[(E)-2-isothiocyanatobut-2-enoyl]oxyoxan-2-yl]-2,3-dihydroxy-6-imino-5-oxocyclohexene-1-carboxylic acid
C34H46N2O17S
Orb3024765 chemical structure, C33H44N2O17S
Orb3024765
C33H44N2O17S
Paulomycin F chemical structure, C29H38N2O16S, CAS 114413-27-3
Paulomycin F
CAS 114413-27-3C29H38N2O16S
Paulomycin E chemical structure, C29H36N2O16S, CAS 101411-69-2
Paulomycin E
CAS 101411-69-2C29H36N2O16S
Paulomycin D chemical structure, C31H40N2O17S, CAS 101411-67-0
Paulomycin D
CAS 101411-67-0C31H40N2O17S
Paulomycin C chemical structure, C32H42N2O17S, CAS 113603-73-9
Paulomycin C
CAS 113603-73-9C32H42N2O17S
Paulomycin A2 chemical structure, C34H46N2O17S, CAS 101411-68-1
Paulomycin A2
CAS 101411-68-1C34H46N2O17S
Paulomenol B chemical structure, C28H41NO16, CAS 97670-28-5
Paulomenol B
CAS 97670-28-5C28H41NO16