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Murcko scaffold

Ring system with 2 rings and 20 atoms

11 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
20
Chemicals
11
With full pages
0
Scaffold SMILES

O=C(C=Cc1ccccc1)OCCOC1CCCCO1

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=C(C=Cc1ccccc1)OCCOC1CCCCO1

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 11 of 11 chemicals

Regaloside B chemical structure, C20H26O11, CAS 114420-67-6
Regaloside B
CAS 114420-67-6C20H26O11
Pubescenoside B chemical structure, C20H26O11, CAS 850878-25-0
Pubescenoside B
CAS 850878-25-0C20H26O11
Regaloside D chemical structure, C18H24O10, CAS 120601-66-3
Regaloside D
CAS 120601-66-3C18H24O10
Regaloside H chemical structure, C18H24O10, CAS 126239-77-8
Regaloside H
CAS 126239-77-8C18H24O10
Regaloside K chemical structure, C18H24O11, CAS 138772-00-6
Regaloside K
CAS 138772-00-6C18H24O11
Regaloside E chemical structure, C20H26O12
Regaloside E
C20H26O12
[(2S)-3-Acetyloxy-2-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate chemical structure, C20H26O12
[(2S)-3-Acetyloxy-2-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
C20H26O12
Regaloside I chemical structure, C20H26O11, CAS 126239-78-9
Regaloside I
CAS 126239-78-9C20H26O11
Oblongaroside B chemical structure, C20H26O10, CAS 1000889-11-1
Oblongaroside B
CAS 1000889-11-1C20H26O10
(S)-3-Acetoxy-2-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)propyl (E)-3-(3,4-dihydroxyphenyl)acrylate chemical structure, C20H26O12, CAS 123134-21-4
(S)-3-Acetoxy-2-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)propyl (E)-3-(3,4-dihydroxyphenyl)acrylate
CAS 123134-21-4C20H26O12
[3-Acetyloxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate chemical structure, C20H26O12
[3-Acetyloxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
C20H26O12