Murcko scaffold
Ring system with 3 rings and 30 atoms
32 chemicals on CompoundList share this ring system.
- Rings
- 3
- Scaffold atoms
- 30
- Chemicals
- 32
- With full pages
- 4
Scaffold SMILES
O=C(CCc1c[nH]c2ccccc12)NCC(=O)NCC(=O)NCCc1ccccc1
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.
![Murcko scaffold O=C(CCc1c[nH]c2ccccc12)NCC(=O)NCC(=O)NCCc1ccccc1](/scaffold/OQEXYHOVWSYAHM-UHFFFAOYSA-N/structure.svg)
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
![5,9,12,15-Tetrahydroxy-17-{hydroxy[(1-hydroxy-1-imino-3-phenylpropan-2-yl)imino]methyl}-11-[(1H-indol-3-yl)methyl]-2-methyl-14-[2-(methylsulfanyl)ethyl]-4-oxa-6,10,13,16-tetraazanonadeca-5,9,12,15-tetraen-19-oic acid chemical structure, C37H49N7O9S, CAS 15686-70-1](/s/ALXRNCVIQSDJAO-UHFFFAOYSA-N.svg)
5,9,12,15-Tetrahydroxy-17-{hydroxy[(1-hydroxy-1-imino-3-phenylpropan-2-yl)imino]methyl}-11-[(1H-indol-3-yl)methyl]-2-methyl-14-[2-(methylsulfanyl)ethyl]-4-oxa-6,10,13,16-tetraazanonadeca-5,9,12,15-tetraen-19-oic acid
CAS 15686-70-1C37H49N7O9S
Amogastrin
CAS 16870-37-4C35H46N6O8S
Butyloxycarbonyl-tryptophyl-methionyl-aspartyl-phenylalaninamide
CAS 5235-21-2C34H44N6O8S
1-Methyl N-(N-(N-(N-((tert-butoxy)carbonyl)-L-tryptophyl)-L-methionyl)-L-alpha-aspartyl)-3-phenyl-L-alaninate
CAS 5262-09-9C35H45N5O9S
N(alpha)-formyltetragastrin
CAS 66025-31-8C30H36N6O7S
tert-Butyloxycarbonyl-aminooxyacetyl-tryptophyl-methionyl-aspartyl-phenylalaninamide
CAS 68172-06-5C36H47N7O10S
Tryptophyl-norleucyl-arginyl-phenylalaninamide
CAS 83903-33-7C32H45N9O4
Tertiary-Butyloxycarbonyl-glycyl-tryptophyl-methionyl-aspartyl-phenylalaninamide
CAS 5915-71-9C36H47N7O9S
Butyloxycarbonyl-tryptophyl-leucyl-aspartyl-phenylalaninamide
CAS 17554-05-1C35H46N6O8
Acetyltetragastrin
CAS 6675-94-1C31H38N6O7S
Boc-trp-leu-asp-phe-nhnh2
CAS 125598-87-0C35H47N7O8
Tetragastrin
CAS 1947-37-1C29H36N6O6S
Cholecystokinin pentapeptide
CAS 18917-24-3C31H39N7O7S
Cholecystokinin hexapeptide
CAS 21163-42-8C36H48N8O8S2
Cck-4
CAS 35144-91-3C29H36N6O6S
Jmv 332
CAS 130582-12-6C44H58N10O11
Cecropin A (1-7)-Melittin A (2-9) amide
CAS 157606-25-2C89H152N22O15
Pentagastrin
CAS 5534-95-2C37H49N7O9S
L-Tyrosine, L-tryptophylglycylglycyl-
CAS 15035-25-3C24H27N5O6
Tetragastrin hydrochloride
CAS 5609-49-4C29H37ClN6O6S
Boc-Met-Gly-Trp-Met-Asp-Phe-NH2
CAS 23446-11-9C41H56N8O10S2
Leu-Trp-Met-Arg-Phe-Ala
CAS 53214-98-5C40H58N10O7S
Cecropin A (1-33)
CAS 81541-05-1C128H216N36O32
Leu-Trp-Met-Arg-Phe
CAS 67201-39-2C37H53N9O6S
- beta-Alanyltryptophylmethionyl-alpha-aspartylphenylalaninamide21880-05-7C32H41N7O7S
- L-Tryptophylglycylglycyl-L-phenylalanyl-L-leucyl-N~5~-(diaminomethylidene)-L-ornithine388610-84-2C36H50N10O7
- L-Tryptophylglycylglycyl-L-phenylalanyl-L-methionine60117-23-9C29H36N6O6S
- 4-[(1-Amino-1-oxo-3-phenylpropan-2-yl)amino]-3-[2-[[3-(1H-indol-3-yl)-2-[[3-oxo-3-(pentylamino)propanoyl]amino]propanoyl]-methylamino]hexanoylamino]-4-oxobutanoic acid474913-73-0C39H53N7O8
- Pantinin-12383114-96-1C75H119N17O18
- HiBiT tag1628912-54-8C63H101N17O14
- CCKBR agonist-12923120-30-1C32H39BrN6O7
- DrkBiT1628913-96-1C60H94N14O14
Related scaffolds
Same ring framework with different atoms or bond orders
![Scaffold O=C(CCc1ccccc1)NCC(=O)NCC(=O)NCCc1c[nH]c2ccccc12](/scaffold/YDJONNPYAWLVPP-UHFFFAOYSA-N/structure.svg)
![Scaffold O=C(CCCCCc1ccccc1)NCC(=O)NCCc1c[nH]c2ccccc12](/scaffold/ULHLHISOYNCGIW-UHFFFAOYSA-N/structure.svg)