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Murcko scaffold

Ring system with 6 rings and 30 atoms

8 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
30
Chemicals
8
With full pages
3
Scaffold SMILES

O=C1OCc2c1c(-c1ccc3c(c1)OCO3)c1ccccc1c2OC1CCCCO1

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=C1OCc2c1c(-c1ccc3c(c1)OCO3)c1ccccc1c2OC1CCCCO1

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 8 of 8 chemicals

Cleistanthin B chemical structure, C27H26O12, CAS 30021-77-3
Cleistanthin B
CAS 30021-77-3C27H26O12
Patentiflorin A chemical structure, C27H26O11, CAS 857050-63-6
Patentiflorin A
CAS 857050-63-6C27H26O11
4-O-(beta-D-Fucopyranosyl)diphyllin chemical structure, C27H26O11, CAS 1042423-12-0
4-O-(beta-D-Fucopyranosyl)diphyllin
CAS 1042423-12-0C27H26O11
Acutissimalignan A chemical structure, C26H24O11, CAS 1005390-46-4
Acutissimalignan A
CAS 1005390-46-4C26H24O11
Cleistanthin chemical structure, C28H28O11, CAS 25047-48-7
Cleistanthin
CAS 25047-48-7C28H28O11
Phyllanthusmin B chemical structure, C28H26O12, CAS 914639-25-1
Phyllanthusmin B
CAS 914639-25-1C28H26O12
9-(1,3-Dioxaindan-5-yl)-6,7-dimethoxy-4-{[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-1H,3H-naphtho[2,3-c]furan-1-one chemical structure, C27H26O11, CAS 2743427-53-2
9-(1,3-Dioxaindan-5-yl)-6,7-dimethoxy-4-{[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-1H,3H-naphtho[2,3-c]furan-1-one
CAS 2743427-53-2C27H26O11
(2S,3R,4S,5S)-2-((9-(Benzo[d][1,3]dioxol-5-yl)-5-chloro-6,7-dimethoxy-1-oxo-1,3-dihydronaphtho[2,3-c]furan-4-yl)oxy)tetrahydro-2H-pyran-3,4,5-triyl triacetate chemical structure, C32H29ClO14, CAS 2289658-83-7
(2S,3R,4S,5S)-2-((9-(Benzo[d][1,3]dioxol-5-yl)-5-chloro-6,7-dimethoxy-1-oxo-1,3-dihydronaphtho[2,3-c]furan-4-yl)oxy)tetrahydro-2H-pyran-3,4,5-triyl triacetate
CAS 2289658-83-7C32H29ClO14