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Murcko scaffold

Ring system with 2 rings and 22 atoms

4 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
22
Chemicals
4
With full pages
1
Scaffold SMILES

O=C1CCOC(=O)CNC(=O)CNC(=O)c2csc(n2)CN1

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=C1CCOC(=O)CNC(=O)CNC(=O)c2csc(n2)CN1

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 4 of 4 chemicals

(7S,10S)-4,4-Dimethyl-7-propan-2-yl-10-[(E)-4-sulfanylbut-1-enyl]-9-oxa-16-thia-3,6,13,18-tetrazabicyclo[13.2.1]octadeca-1(17),15(18)-diene-2,5,8,12-tetrone chemical structure, C21H30N4O5S2, CAS 1315334-23-6
(7S,10S)-4,4-Dimethyl-7-propan-2-yl-10-[(E)-4-sulfanylbut-1-enyl]-9-oxa-16-thia-3,6,13,18-tetrazabicyclo[13.2.1]octadeca-1(17),15(18)-diene-2,5,8,12-tetrone
CAS 1315334-23-6C21H30N4O5S2
Bocodepsin chemical structure, C26H39N5O6S2, CAS 1834513-65-3
Bocodepsin
CAS 1834513-65-3C26H39N5O6S2
Bocodepsin besylate chemical structure, C32H45N5O9S3, CAS 1834513-67-5
Bocodepsin besylate
CAS 1834513-67-5C32H45N5O9S3
Bocodepsin (hydrochloride) chemical structure, C26H40ClN5O6S2, CAS 1834513-66-4
Bocodepsin (hydrochloride)
CAS 1834513-66-4C26H40ClN5O6S2