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Murcko scaffold

Ring system with 3 rings and 19 atoms

17 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
19
Chemicals
17
With full pages
4
Scaffold SMILES

c1ccc(CCCCc2ccc3c(c2)OCO3)cc1

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 c1ccc(CCCCc2ccc3c(c2)OCO3)cc1

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

(+)-Dihydroclusin chemical structure, C22H28O7, CAS 72627-53-3
(+)-Dihydroclusin
CAS 72627-53-3C22H28O7
(-)-Dihydroclusin chemical structure, C22H28O7, CAS 73149-51-6
(-)-Dihydroclusin
CAS 73149-51-6C22H28O7
(2R,3S)-2-(1,3-Benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]butane-1,4-diol chemical structure, C22H28O7, CAS 73510-54-0
(2R,3S)-2-(1,3-Benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]butane-1,4-diol
CAS 73510-54-0C22H28O7
1-(1,3-Benzodioxol-5-yl)-4-phenylbutan-1-ol chemical structure, C17H18O3, CAS 16409-26-0
1-(1,3-Benzodioxol-5-yl)-4-phenylbutan-1-ol
CAS 16409-26-0C17H18O3
Nirphyllin chemical structure, C24H32O8, CAS 120396-54-5
Nirphyllin
CAS 120396-54-5C24H32O8
(2S,3S,4S)-4-(1,3-Benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]pentane-1,2,5-triol chemical structure, C23H30O8, CAS 76236-36-7
(2S,3S,4S)-4-(1,3-Benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]pentane-1,2,5-triol
CAS 76236-36-7C23H30O8
erythro-Austrobailignan-6 chemical structure, C20H24O4, CAS 114127-24-1
erythro-Austrobailignan-6
CAS 114127-24-1C20H24O4
Macelignan chemical structure, C20H24O4, CAS 107534-93-0
Macelignan
CAS 107534-93-0C20H24O4
Niranthin chemical structure, C24H32O7, CAS 50656-77-4
Niranthin
CAS 50656-77-4C24H32O7
rel-4-[(2R,3R)-4-(1,3-Benzodioxol-5-yl)-2,3-dimethylbutyl]-2-methoxyphenol chemical structure, C20H24O4, CAS 130008-79-6
rel-4-[(2R,3R)-4-(1,3-Benzodioxol-5-yl)-2,3-dimethylbutyl]-2-methoxyphenol
CAS 130008-79-6C20H24O4
5-[4-(3,4-Dimethoxyphenyl)-2,3-dimethylbutyl]-2H-1,3-benzodioxole chemical structure, C21H26O4, CAS 129684-08-8
5-[4-(3,4-Dimethoxyphenyl)-2,3-dimethylbutyl]-2H-1,3-benzodioxole
CAS 129684-08-8C21H26O4
Kadangustin I chemical structure, C22H28O7, CAS 1013633-27-6
Kadangustin I
CAS 1013633-27-6C22H28O7
Sphenanlignan chemical structure, C21H26O5, CAS 866347-36-6
Sphenanlignan
CAS 866347-36-6C21H26O5
Saurulignan A chemical structure, C20H24O5, CAS 1532522-50-1
Saurulignan A
CAS 1532522-50-1C20H24O5
Kadsurindutin E chemical structure, C20H24O5, CAS 1670237-95-2
Kadsurindutin E
CAS 1670237-95-2C20H24O5
1,4-O-Didesmethyl rac-Niranthin chemical structure, C22H28O7, CAS 81263-83-4
1,4-O-Didesmethyl rac-Niranthin
CAS 81263-83-4C22H28O7
Isoanwulignan chemical structure, C20H24O4, CAS 143601-12-1
Isoanwulignan
CAS 143601-12-1C20H24O4