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Murcko scaffold

Ring system with 5 rings and 21 atoms

9 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
21
Chemicals
9
With full pages
2
Scaffold SMILES

O=c1c2ccccc2oc2c3c(ccc12)OC1OCCC31

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=c1c2ccccc2oc2c3c(ccc12)OC1OCCC31

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 9 of 9 chemicals

O-Acetyldihydrosterigmatocystin chemical structure, C20H16O7, CAS 58086-33-2
O-Acetyldihydrosterigmatocystin
CAS 58086-33-2C20H16O7
De-O-methyldihydrosterigmatocystin chemical structure, C17H12O6, CAS 30517-66-9
De-O-methyldihydrosterigmatocystin
CAS 30517-66-9C17H12O6
5,6-Dimethoxydihydrosterigmatocystin chemical structure, C20H18O8, CAS 74494-65-8
5,6-Dimethoxydihydrosterigmatocystin
CAS 74494-65-8C20H18O8
5-Methoxydihydrosterigmatocystin chemical structure, C19H16O7, CAS 101489-25-2
5-Methoxydihydrosterigmatocystin
CAS 101489-25-2C19H16O7
17-Hydroxy-16,17-dihydrosterigmatocystin chemical structure, C18H14O7, CAS 109278-36-6
17-Hydroxy-16,17-dihydrosterigmatocystin
CAS 109278-36-6C18H14O7
7H-Furo(3',2':4,5)furo(2,3-c)xanthen-7-one, 2-(acetyloxy)-1,2,3a,12c-tetrahydro-8-hydroxy-6-methoxy- chemical structure, C20H16O8, CAS 38746-53-1
7H-Furo(3',2':4,5)furo(2,3-c)xanthen-7-one, 2-(acetyloxy)-1,2,3a,12c-tetrahydro-8-hydroxy-6-methoxy-
CAS 38746-53-1C20H16O8
Dihydrohydroxy-O-methylsterigmatocystin chemical structure, C19H16O7, CAS 30099-66-2
Dihydrohydroxy-O-methylsterigmatocystin
CAS 30099-66-2C19H16O7
8-O-Methyldihydrosterigmatocystin chemical structure, C19H16O6, CAS 24945-81-1
8-O-Methyldihydrosterigmatocystin
CAS 24945-81-1C19H16O6
(3aR,12cS)-1,2,3a,12c-Tetrahydro-8-hydroxy-6-methoxy-7H-furo(3',2':4,5)furo(2,3-c)xanthen-7-one chemical structure, C18H14O6, CAS 6795-16-0
(3aR,12cS)-1,2,3a,12c-Tetrahydro-8-hydroxy-6-methoxy-7H-furo(3',2':4,5)furo(2,3-c)xanthen-7-one
CAS 6795-16-0C18H14O6