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Murcko scaffold

Ring system with 4 rings and 35 atoms

10 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
35
Chemicals
10
With full pages
2
Scaffold SMILES

O=C(C=Cc1ccccc1)OCC1CC(OC(=O)C=Cc2ccccc2)C(OC2CCCCO2)O1

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)OCC1CC(OC(=O)C=Cc2ccccc2)C(OC2CCCCO2)O1

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 10 of 10 chemicals

[(2R,3R,4S,5R)-5-(Acetyloxymethyl)-5-[(2R,3R,4S,5S,6R)-3,5-diacetyloxy-6-(acetyloxymethyl)-4-hydroxyoxan-2-yl]oxy-3-hydroxy-4-[(E)-3-phenylprop-2-enoyl]oxyoxolan-2-yl]methyl (E)-3-phenylprop-2-enoate chemical structure, C38H42O17
[(2R,3R,4S,5R)-5-(Acetyloxymethyl)-5-[(2R,3R,4S,5S,6R)-3,5-diacetyloxy-6-(acetyloxymethyl)-4-hydroxyoxan-2-yl]oxy-3-hydroxy-4-[(E)-3-phenylprop-2-enoyl]oxyoxolan-2-yl]methyl (E)-3-phenylprop-2-enoate
C38H42O17
Lapathoside D chemical structure, C30H34O15, CAS 373646-84-5
Lapathoside D
CAS 373646-84-5C30H34O15
1,2',4',6'-Tetraacetyl-3,6-diferuloylsucrose chemical structure, C40H46O21, CAS 173614-59-0
1,2',4',6'-Tetraacetyl-3,6-diferuloylsucrose
CAS 173614-59-0C40H46O21
Smilaside A chemical structure, C36H42O19, CAS 154287-51-1
Smilaside A
CAS 154287-51-1C36H42O19
Smilaside B chemical structure, C34H40O18, CAS 870296-06-3
Smilaside B
CAS 870296-06-3C34H40O18
Helonioside A chemical structure, C32H38O17, CAS 107647-20-1
Helonioside A
CAS 107647-20-1C32H38O17
Helonioside B chemical structure, C34H40O18, CAS 107647-21-2
Helonioside B
CAS 107647-21-2C34H40O18
Niruriside chemical structure, C38H42O17, CAS 173268-90-1
Niruriside
CAS 173268-90-1C38H42O17
[5-(Acetyloxymethyl)-5-[3,5-diacetyloxy-6-(acetyloxymethyl)-4-hydroxyoxan-2-yl]oxy-3-hydroxy-4-(3-phenylprop-2-enoyloxy)oxolan-2-yl]methyl 3-phenylprop-2-enoate chemical structure, C38H42O17
[5-(Acetyloxymethyl)-5-[3,5-diacetyloxy-6-(acetyloxymethyl)-4-hydroxyoxan-2-yl]oxy-3-hydroxy-4-(3-phenylprop-2-enoyloxy)oxolan-2-yl]methyl 3-phenylprop-2-enoate
C38H42O17
Tenuifoliside E chemical structure, C41H48O22, CAS 162901-87-3
Tenuifoliside E
CAS 162901-87-3C41H48O22