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Murcko scaffold

Ring system with 5 rings and 24 atoms

69 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
24
Chemicals
69
With full pages
8
Scaffold SMILES

C1=C2CC(OC3CCCCO3)CCC2C2CCC3CCCC3C2C1

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 C1=C2CC(OC3CCCCO3)CCC2C2CCC3CCCC3C2C1

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 49 to 69 of 69 chemicals

Methyl (4R)-4-[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-3-(oxan-2-yloxy)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate chemical structure, C30H48O4, CAS 66414-42-4
Methyl (4R)-4-[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-3-(oxan-2-yloxy)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
CAS 66414-42-4C30H48O4
Caudatin-3-O-beta-cymaropyranoside chemical structure, C35H54O10, CAS 182363-54-8
Caudatin-3-O-beta-cymaropyranoside
CAS 182363-54-8C35H54O10
Stigmast-5-en-3-yl beta-D-glucopyranosiduronic acid chemical structure, C35H58O7, CAS 126251-01-2
Stigmast-5-en-3-yl beta-D-glucopyranosiduronic acid
CAS 126251-01-2C35H58O7
22-Dehydroclerosterol glucoside chemical structure, C35H56O6, CAS 143815-99-0
22-Dehydroclerosterol glucoside
CAS 143815-99-0C35H56O6
Clerosterol glucoside chemical structure, C35H58O6, CAS 123621-00-1
Clerosterol glucoside
CAS 123621-00-1C35H58O6
Mogroside IE chemical structure, C36H62O9, CAS 88901-39-7
Mogroside IE
CAS 88901-39-7C36H62O9
18:1-Glc-stigmasterol chemical structure, C53H90O7, CAS 111103-97-0
18:1-Glc-stigmasterol
CAS 111103-97-0C53H90O7
(20R)-16beta,20-Dihydroxypregn-5-en-3beta-yl beta-D-glucopyranoside chemical structure, C27H44O8, CAS 171828-53-8
(20R)-16beta,20-Dihydroxypregn-5-en-3beta-yl beta-D-glucopyranoside
CAS 171828-53-8C27H44O8
Sitosterol 3-O-beta-galactopyranoside chemical structure, C35H60O6, CAS 55057-29-9
Sitosterol 3-O-beta-galactopyranoside
CAS 55057-29-9C35H60O6
Bethoside C chemical structure, C33H56O9, CAS 1142859-78-6
Bethoside C
CAS 1142859-78-6C33H56O9
(24Z)-Stigmasta-5,24(28)-dien-3beta-yl 6-O-[(9Z,12Z)-octadeca-9,12-dienoyl]-beta-D-glucopyranoside chemical structure, C53H88O7, CAS 209903-47-9
(24Z)-Stigmasta-5,24(28)-dien-3beta-yl 6-O-[(9Z,12Z)-octadeca-9,12-dienoyl]-beta-D-glucopyranoside
CAS 209903-47-9C53H88O7
3-O-beta-D-Glucosyl-brassicasterol chemical structure, C34H56O6, CAS 51587-44-1
3-O-beta-D-Glucosyl-brassicasterol
CAS 51587-44-1C34H56O6
19-Norlanosta-5,23-diene-9-carboxaldehyde, 3-(beta-D-allopyranosyloxy)-7-hydroxy-25-methoxy-, (3beta,7beta,9beta,10alpha,23E)- chemical structure, C37H60O9, CAS 1446446-11-2
19-Norlanosta-5,23-diene-9-carboxaldehyde, 3-(beta-D-allopyranosyloxy)-7-hydroxy-25-methoxy-, (3beta,7beta,9beta,10alpha,23E)-
CAS 1446446-11-2C37H60O9
18:1-Glc-campesterol chemical structure, C52H90O7, CAS 87168-08-9
18:1-Glc-campesterol
CAS 87168-08-9C52H90O7
25,26-Dehydro beta-Sitosterol beta-D-Glucoside chemical structure, C35H58O6, CAS 4281-99-6
25,26-Dehydro beta-Sitosterol beta-D-Glucoside
CAS 4281-99-6C35H58O6
?-Sitosterol ?-D-glucuronide chemical structure, C35H58O7
?-Sitosterol ?-D-glucuronide
C35H58O7
20,20-Dimethyl-3beta-[(oxan-2-yl)oxy]pregn-5-ene chemical structure, C28H46O2, CAS 64421-32-5
20,20-Dimethyl-3beta-[(oxan-2-yl)oxy]pregn-5-ene
CAS 64421-32-5C28H46O2
20-(Dimethylamino)pregn-5-en-3beta-yl beta-D-glucopyranoside chemical structure, C29H49NO6, CAS 128255-19-6
20-(Dimethylamino)pregn-5-en-3beta-yl beta-D-glucopyranoside
CAS 128255-19-6C29H49NO6
(2R,4S,5R,6R)-2-[[(3S,8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4-hydroxy-5-(2-oxoethylamino)-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid chemical structure, C38H63NO9, CAS 111564-44-4
(2R,4S,5R,6R)-2-[[(3S,8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4-hydroxy-5-(2-oxoethylamino)-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
CAS 111564-44-4C38H63NO9
Galactosyl cholesterol chemical structure, C33H56O6
Galactosyl cholesterol
C33H56O6
Orb3144754 chemical structure, C35H58O6, CAS 2098402-54-9
Orb3144754
CAS 2098402-54-9C35H58O6