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Murcko scaffold

Ring system with 2 rings and 32 atoms

7 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
32
Chemicals
7
With full pages
1
Scaffold SMILES

O=C1C=CC=CCC(OC2CCCCO2)C=CC=CCCCCC=CC=CCCCCO1

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=CC=CCC(OC2CCCCO2)C=CC=CCCCCC=CC=CCCCCO1

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 7 of 7 chemicals

Macrolactin P chemical structure, C31H46O10, CAS 956479-53-1
Macrolactin P
CAS 956479-53-1C31H46O10
Macrolactin R chemical structure, C30H44O10, CAS 956479-59-7
Macrolactin R
CAS 956479-59-7C30H44O10
Macrolactin Q chemical structure, C30H44O10, CAS 956479-58-6
Macrolactin Q
CAS 956479-58-6C30H44O10
Gageomacrolactin 2 chemical structure, C31H46O10, CAS 1428653-22-8
Gageomacrolactin 2
CAS 1428653-22-8C31H46O10
14-Hydroxy-16-methoxy-24-methyl-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-oxacyclotetracosa-3,5,9,11,17,19-hexaen-2-one chemical structure, C31H46O10
14-Hydroxy-16-methoxy-24-methyl-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-oxacyclotetracosa-3,5,9,11,17,19-hexaen-2-one
C31H46O10
Macrolactin B chemical structure, C30H44O10, CAS 122540-28-7
Macrolactin B
CAS 122540-28-7C30H44O10
(3Z,5E,8S,9E,11E,14S,16R,19E,24R)-14-Hydroxy-16-methoxy-24-methyl-8-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-oxacyclotetracosa-3,5,9,11,17,19-hexaen-2-one chemical structure, C31H46O10
(3Z,5E,8S,9E,11E,14S,16R,19E,24R)-14-Hydroxy-16-methoxy-24-methyl-8-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-oxacyclotetracosa-3,5,9,11,17,19-hexaen-2-one
C31H46O10