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Murcko scaffold

Ring system with 5 rings and 31 atoms

17 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
31
Chemicals
17
With full pages
4
Scaffold SMILES

O=c1c(OC2CCC(OC3CCCCO3)CO2)c(-c2ccccc2)oc2ccccc12

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(OC2CCC(OC3CCCCO3)CO2)c(-c2ccccc2)oc2ccccc12

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 17 of 17 chemicals

Multiflorin B chemical structure, C27H30O15, CAS 52657-01-9
Multiflorin B
CAS 52657-01-9C27H30O15
Multiflorin A chemical structure, C29H32O16, CAS 1350028-90-8
Multiflorin A
CAS 1350028-90-8C29H32O16
Multinoside A chemical structure, C27H30O16, CAS 59262-54-3
Multinoside A
CAS 59262-54-3C27H30O16
Rhamnetin-3-O-neohesperidoside chemical structure, C28H32O16, CAS 101330-77-2
Rhamnetin-3-O-neohesperidoside
CAS 101330-77-2C28H32O16
Cassiglucin chemical structure, C28H32O17, CAS 73815-19-7
Cassiglucin
CAS 73815-19-7C28H32O17
4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-((4-O-beta-D-mannopyranosyl-beta-D-glucopyranosyl)oxy)- chemical structure, C27H30O16, CAS 78134-93-7
4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-((4-O-beta-D-mannopyranosyl-beta-D-glucopyranosyl)oxy)-
CAS 78134-93-7C27H30O16
Baohuoside VII chemical structure, C33H40O15, CAS 119730-89-1
Baohuoside VII
CAS 119730-89-1C33H40O15
Isorhamnetin-3-O-glucosyl-(1->4)-O-rhamnoside chemical structure, C28H32O16, CAS 1135753-17-1
Isorhamnetin-3-O-glucosyl-(1->4)-O-rhamnoside
CAS 1135753-17-1C28H32O16
Quercetin-3-rham(4)-gluc chemical structure, C27H30O16, CAS 123160-33-8
Quercetin-3-rham(4)-gluc
CAS 123160-33-8C27H30O16
Nervilifordin A chemical structure, C27H30O15, CAS 1149669-49-7
Nervilifordin A
CAS 1149669-49-7C27H30O15
Nervilifordin B chemical structure, C28H32O16, CAS 1149669-50-0
Nervilifordin B
CAS 1149669-50-0C28H32O16
Nervilifordin C chemical structure, C28H32O17, CAS 1149669-51-1
Nervilifordin C
CAS 1149669-51-1C28H32O17
3-[(6-Deoxy-4-O-beta-D-galactopyranosyl-alpha-L-mannopyranosyl)oxy]-5,7-dihydroxy-2-phenyl-4H-1-benzopyran-4-one chemical structure, C27H30O14, CAS 73030-72-5
3-[(6-Deoxy-4-O-beta-D-galactopyranosyl-alpha-L-mannopyranosyl)oxy]-5,7-dihydroxy-2-phenyl-4H-1-benzopyran-4-one
CAS 73030-72-5C27H30O14
3-[[6-Deoxy-4-O-(6-deoxy-alpha-L-mannopyranosyl)-alpha-L-mannopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one chemical structure, C28H32O15, CAS 105755-71-3
3-[[6-Deoxy-4-O-(6-deoxy-alpha-L-mannopyranosyl)-alpha-L-mannopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one
CAS 105755-71-3C28H32O15
Meratin chemical structure, C27H30O17, CAS 27215-04-9
Meratin
CAS 27215-04-9C27H30O17
4H-1-Benzopyran-4-one, 3-((O-acetyl-6-deoxy-4-O-beta-D-glucopyranosyl-alpha-L-mannopyranosyl)oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)- chemical structure, C29H32O16, CAS 61358-52-9
4H-1-Benzopyran-4-one, 3-((O-acetyl-6-deoxy-4-O-beta-D-glucopyranosyl-alpha-L-mannopyranosyl)oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-
CAS 61358-52-9C29H32O16
Isorhamnetin-3-O-glucosyl-(1->4)-O-rhamnoside chemical structure, C28H32O16
Isorhamnetin-3-O-glucosyl-(1->4)-O-rhamnoside
C28H32O16