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Murcko scaffold

Ring system with 4 rings and 37 atoms

18 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
37
Chemicals
18
With full pages
2
Scaffold SMILES

O=C1C=CCC(CC2OC2c2ccccc2)OC(=O)COC(=O)CCNC(=O)C(Cc2ccccc2)N1

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=C1C=CCC(CC2OC2c2ccccc2)OC(=O)COC(=O)CCNC(=O)C(Cc2ccccc2)N1

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 18 of 18 chemicals

Cryptophycin B chemical structure, C35H44N2O8, CAS 155645-50-4
Cryptophycin B
CAS 155645-50-4C35H44N2O8
Cryptophycin chemical structure, C35H43ClN2O8, CAS 124689-65-2
Cryptophycin
CAS 124689-65-2C35H43ClN2O8
Arenastatin A chemical structure, C34H42N2O8, CAS 162600-54-6
Arenastatin A
CAS 162600-54-6C34H42N2O8
Cryptophycin 52 chemical structure, C36H45ClN2O8, CAS 186256-67-7
Cryptophycin 52
CAS 186256-67-7C36H45ClN2O8
Cryptophycin 21 chemical structure, C34H41ClN2O8, CAS 168569-15-1
Cryptophycin 21
CAS 168569-15-1C34H41ClN2O8
Cryptophycin 31 chemical structure, C35H42Cl2N2O8, CAS 171674-92-3
Cryptophycin 31
CAS 171674-92-3C35H42Cl2N2O8
Cryptophycin 16 chemical structure, C34H41ClN2O8, CAS 169181-93-5
Cryptophycin 16
CAS 169181-93-5C34H41ClN2O8
Cryptophycin 40 chemical structure, C34H41ClN2O8, CAS 168482-41-5
Cryptophycin 40
CAS 168482-41-5C34H41ClN2O8
Cryptophycin 38 chemical structure, C35H43ClN2O8, CAS 179093-39-1
Cryptophycin 38
CAS 179093-39-1C35H43ClN2O8
Cryptophycin 326 chemical structure, C34H40Cl2N2O8, CAS 741730-84-7
Cryptophycin 326
CAS 741730-84-7C34H40Cl2N2O8
Cryptophycin 327 chemical structure, C35H43ClN2O8, CAS 741690-36-8
Cryptophycin 327
CAS 741690-36-8C35H43ClN2O8
Cryptophycin 176 chemical structure, C33H39ClN2O8, CAS 186593-86-2
Cryptophycin 176
CAS 186593-86-2C33H39ClN2O8
Cryptophycin analog 1 chemical structure, C37H48ClN3O8, CAS 1260431-28-4
Cryptophycin analog 1
CAS 1260431-28-4C37H48ClN3O8
Cryptophycin 53 chemical structure, C36H45ClN2O8, CAS 186256-68-8
Cryptophycin 53
CAS 186256-68-8C36H45ClN2O8
(3S,10R,13E,16S)-16-[(1S)-1-[(2R,3R)-3-[4-(Aminomethyl)phenyl]-2-oxiranyl]ethyl]-10-[(3-chloro-4-methoxyphenyl)methyl]-6,6-dimethyl-3-(2-methylpropyl)-1,4-dioxa-8,11-diazacyclohexadec-13-ene-2,5,9,12-tetrone chemical structure, C37H48ClN3O8
(3S,10R,13E,16S)-16-[(1S)-1-[(2R,3R)-3-[4-(Aminomethyl)phenyl]-2-oxiranyl]ethyl]-10-[(3-chloro-4-methoxyphenyl)methyl]-6,6-dimethyl-3-(2-methylpropyl)-1,4-dioxa-8,11-diazacyclohexadec-13-ene-2,5,9,12-tetrone
C37H48ClN3O8
Cryptophycin 49 chemical structure, C34H41ClN2O8, CAS 168482-42-6
Cryptophycin 49
CAS 168482-42-6C34H41ClN2O8
(3S,6R,10R,13E,16S)-10-[(3,5-Dichloro-4-hydroxyphenyl)methyl]-6-methyl-3-(2-methylpropyl)-16-[(1R)-1-[(2R,3R)-3-phenyloxiran-2-yl]ethyl]-1,4-dioxa-8,11-diazacyclohexadec-13-ene-2,5,9,12-tetrone chemical structure, C34H40Cl2N2O8, CAS 168569-16-2
(3S,6R,10R,13E,16S)-10-[(3,5-Dichloro-4-hydroxyphenyl)methyl]-6-methyl-3-(2-methylpropyl)-16-[(1R)-1-[(2R,3R)-3-phenyloxiran-2-yl]ethyl]-1,4-dioxa-8,11-diazacyclohexadec-13-ene-2,5,9,12-tetrone
CAS 168569-16-2C34H40Cl2N2O8
(13Z,16S)-16-[(1S)-1-[(2R,3R)-3-[4-(Aminomethyl)phenyl]oxiran-2-yl]ethyl]-10-[(3-chloro-4-methoxyphenyl)methyl]-6,6-dimethyl-3-(2-methylpropyl)-1,4-dioxa-8,11-diazacyclohexadec-13-ene-2,5,9,12-tetrone chemical structure, C37H48ClN3O8
(13Z,16S)-16-[(1S)-1-[(2R,3R)-3-[4-(Aminomethyl)phenyl]oxiran-2-yl]ethyl]-10-[(3-chloro-4-methoxyphenyl)methyl]-6,6-dimethyl-3-(2-methylpropyl)-1,4-dioxa-8,11-diazacyclohexadec-13-ene-2,5,9,12-tetrone
C37H48ClN3O8