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Murcko scaffold

4H-1-Benzopyran-4-one, 2-(1,3-benzodioxol-5-yl)-2,3-dihydro- scaffold

12 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
20
Chemicals
12
With full pages
1
Scaffold SMILES

O=C1CC(c2ccc3c(c2)OCO3)Oc2ccccc21

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 scaffoldOpen the 4H-1-Benzopyran-4-one, 2-(1,3-benzodioxol-5-yl)-2,3-dihydro- page
Murcko scaffold O=C1CC(c2ccc3c(c2)OCO3)Oc2ccccc21

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 12 of 12 chemicals

Pongapinone B chemical structure, C23H24O6, CAS 146713-94-2
Pongapinone B
CAS 146713-94-2C23H24O6
(2S)-5,7-Dimethoxy-3',4'-methylenedioxyflavanone chemical structure, C18H16O6, CAS 610770-50-8
(2S)-5,7-Dimethoxy-3',4'-methylenedioxyflavanone
CAS 610770-50-8C18H16O6
4H-1-Benzopyran-4-one, 2-(1,3-benzodioxol-5-yl)-2,3-dihydro- chemical structure, C16H12O4, CAS 54401-46-6
4H-1-Benzopyran-4-one, 2-(1,3-benzodioxol-5-yl)-2,3-dihydro-
CAS 54401-46-6C16H12O4
O-Methylovaliflavanone C chemical structure, C22H22O5, CAS 115219-94-8
O-Methylovaliflavanone C
CAS 115219-94-8C22H22O5
Agecorynin A chemical structure, C20H20O8, CAS 77053-46-4
Agecorynin A
CAS 77053-46-4C20H20O8
N-[2-(1,3-Benzodioxol-5-yl)-4-oxo-3,4-dihydro-2H-chromen-6-yl]butanamide chemical structure, C20H19NO5, CAS 938025-81-1
N-[2-(1,3-Benzodioxol-5-yl)-4-oxo-3,4-dihydro-2H-chromen-6-yl]butanamide
CAS 938025-81-1C20H19NO5
Agestricin B chemical structure, C18H16O7, CAS 85563-74-2
Agestricin B
CAS 85563-74-2C18H16O7
Ovaliflavanone C chemical structure, C21H20O5, CAS 75680-31-8
Ovaliflavanone C
CAS 75680-31-8C21H20O5
Ovaliflavanone D chemical structure, C26H28O5, CAS 75680-30-7
Ovaliflavanone D
CAS 75680-30-7C26H28O5
7,2'-Dimethoxy-4',5'-methylenedioxyflavanone chemical structure, C18H16O6, CAS 103197-37-1
7,2'-Dimethoxy-4',5'-methylenedioxyflavanone
CAS 103197-37-1C18H16O6
Ponganone V chemical structure, C22H22O6, CAS 142608-91-1
Ponganone V
CAS 142608-91-1C22H22O6
4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-6-methoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)-, (S)- chemical structure, C18H16O8, CAS 143381-59-3
4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-6-methoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)-, (S)-
CAS 143381-59-3C18H16O8