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Murcko scaffold

Ring system with 6 rings and 33 atoms

38 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
33
Chemicals
38
With full pages
5
Scaffold SMILES

O=C(C=Cc1ccccc1)OC1CCC2C(CCC3C4CCC5CCCCC5C4=CCC23)C1

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)OC1CCC2C(CCC3C4CCC5CCCCC5C4=CCC23)C1

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 38 of 38 chemicals

Urs-12-en-3beta-yl 3-phenylprop-2-enoate chemical structure, C39H56O2
Urs-12-en-3beta-yl 3-phenylprop-2-enoate
C39H56O2
alpha-Amyrin cinnamate chemical structure, C39H56O2
alpha-Amyrin cinnamate
C39H56O2
Npc133429 chemical structure, C39H56O2, CAS 13161-35-8
Npc133429
CAS 13161-35-8C39H56O2
3-O-Coumaroylasiatic acid chemical structure, C39H54O7, CAS 143773-52-8
3-O-Coumaroylasiatic acid
CAS 143773-52-8C39H54O7
3-O-p-Coumaroyloleanolic acid chemical structure, C39H54O5, CAS 151334-06-4
3-O-p-Coumaroyloleanolic acid
CAS 151334-06-4C39H54O5
3beta,23,28-trihydroxy-12-oleanene 3beta-caffeate chemical structure, C39H56O6, CAS 226406-74-2
3beta,23,28-trihydroxy-12-oleanene 3beta-caffeate
CAS 226406-74-2C39H56O6
3-O-(E)-Coumaroylerythrodiol chemical structure, C39H56O4, CAS 113476-64-5
3-O-(E)-Coumaroylerythrodiol
CAS 113476-64-5C39H56O4
3-O-Coumaroylarjunolic acid chemical structure, C39H54O7, CAS 171864-20-3
3-O-Coumaroylarjunolic acid
CAS 171864-20-3C39H54O7
Erythrodiol-3-caffeate chemical structure, C39H56O5, CAS 113493-20-2
Erythrodiol-3-caffeate
CAS 113493-20-2C39H56O5
3-O-cis-p-Coumaroyltormentic acid chemical structure, C39H54O7
3-O-cis-p-Coumaroyltormentic acid
C39H54O7
3-O-trans-p-Coumaroyltormentic acid chemical structure, C39H54O7, CAS 121064-78-6
3-O-trans-p-Coumaroyltormentic acid
CAS 121064-78-6C39H54O7
3-O-cis-p-Coumaroyltormentic acid chemical structure, C39H54O7, CAS 121072-40-0
3-O-cis-p-Coumaroyltormentic acid
CAS 121072-40-0C39H54O7
3beta-[[(E)-3-(4-Hydroxyphenyl)propenoyl]oxy]-2alpha-hydroxyurs-12-ene-28-oic acid chemical structure, C39H54O6, CAS 63303-42-4
3beta-[[(E)-3-(4-Hydroxyphenyl)propenoyl]oxy]-2alpha-hydroxyurs-12-ene-28-oic acid
CAS 63303-42-4C39H54O6
11-Hydroxy-10-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid chemical structure, C39H54O6
11-Hydroxy-10-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
C39H54O6
3beta-O-(trans-p-Coumaroyl)maslinic acid chemical structure, C39H54O6, CAS 35482-91-8
3beta-O-(trans-p-Coumaroyl)maslinic acid
CAS 35482-91-8C39H54O6
Urs-12-en-28-oic acid, 2-hydroxy-3-[[(2E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]oxy]-, (2I+/-,3I+/-)- chemical structure, C40H56O7, CAS 351333-71-6
Urs-12-en-28-oic acid, 2-hydroxy-3-[[(2E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]oxy]-, (2I+/-,3I+/-)-
CAS 351333-71-6C40H56O7
cis-3-O-p-Hydroxycinnamoyl ursolic acid chemical structure, C39H54O5, CAS 331243-42-6
cis-3-O-p-Hydroxycinnamoyl ursolic acid
CAS 331243-42-6C39H54O5
3-(p-Coumaroyl)ursolic acid chemical structure, C39H54O5, CAS 50627-73-1
3-(p-Coumaroyl)ursolic acid
CAS 50627-73-1C39H54O5
3-O-Caffeoyloleanolic acid chemical structure, C39H54O6, CAS 97534-10-6
3-O-Caffeoyloleanolic acid
CAS 97534-10-6C39H54O6
3beta-{[(2E)-3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy}-2alpha,19-dihydroxyurs-12-en-28-oic acid chemical structure, C39H54O8, CAS 144604-16-0
3beta-{[(2E)-3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy}-2alpha,19-dihydroxyurs-12-en-28-oic acid
CAS 144604-16-0C39H54O8
3-p-Coumaroylrotundic acid chemical structure, C39H54O7, CAS 144624-03-3
3-p-Coumaroylrotundic acid
CAS 144624-03-3C39H54O7
1,11-Dihydroxy-10-[3-(4-hydroxyphenyl)prop-2-enoyloxy]-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid chemical structure, C39H54O7
1,11-Dihydroxy-10-[3-(4-hydroxyphenyl)prop-2-enoyloxy]-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
C39H54O7
3-beta-O-(cis-p-Coumaroyl)maslinic acid chemical structure, C39H54O6
3-beta-O-(cis-p-Coumaroyl)maslinic acid
C39H54O6
(3beta)-3-[[(2e)-3-(4-Chlorophenyl)-1-oxo-2-propenyl]oxy]-olean-12-en-28-oic acid chemical structure, C39H53ClO4, CAS 892869-42-0
(3beta)-3-[[(2e)-3-(4-Chlorophenyl)-1-oxo-2-propenyl]oxy]-olean-12-en-28-oic acid
CAS 892869-42-0C39H53ClO4