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Murcko scaffold

Ring system with 6 rings and 30 atoms

168 chemicals on CompoundList share this ring system.

Rings: 6
Scaffold atoms: 30
Chemicals: 168
With full pages: 42

Scaffold SMILES

O=C1C=C(C2CCC3C2CCC2C4CCC(OC5CCCCO5)CC4CCC23)CO1

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=C(C2CCC3C2CCC2C4CCC(OC5CCCCO5)CC4CCC23)CO1

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 48 of 168 chemicals

Sinoside chemical structure, C30H44O9, CAS 507-87-9

CAS 507-87-9C₃₀H₄₄O₉

Sarmentoside D chemical structure, C29H42O11, CAS 11005-45-1

CAS 11005-45-1C₂₉H₄₂O₁₁

11-Epi-sarnovid chemical structure, C30H46O9, CAS 514-37-4

11-Epi-sarnovid

CAS 514-37-4C₃₀H₄₆O₉

3-[(6-Deoxyhexopyranosyl)oxy]-5,12,14-trihydroxy-19-oxocard-20(22)-enolide chemical structure, C29H42O11, CAS 1366-99-0

3-[(6-Deoxyhexopyranosyl)oxy]-5,12,14-trihydroxy-19-oxocard-20(22)-enolide

CAS 1366-99-0C₂₉H₄₂O₁₁

3-((6-Deoxyhexopyranosyl)oxy)-5,14,19-trihydroxycard-20(22)-enolide chemical structure, C29H44O10, CAS 3253-62-1

3-((6-Deoxyhexopyranosyl)oxy)-5,14,19-trihydroxycard-20(22)-enolide

CAS 3253-62-1C₂₉H₄₄O₁₀

Apocannoside chemical structure, C30H44O8, CAS 3751-87-9

CAS 3751-87-9C₃₀H₄₄O₈

Card-20(22)-enolide, 3-((6-deoxy-beta-D-allopyranosyl)oxy)-5,14-dihydroxy-, (3-beta,5-beta)- chemical structure, C29H44O9, CAS 3981-14-4

Card-20(22)-enolide, 3-((6-deoxy-beta-D-allopyranosyl)oxy)-5,14-dihydroxy-, (3-beta,5-beta)-

CAS 3981-14-4C₂₉H₄₄O₉

3-(Hexopyranosyloxy)-5,14-dihydroxy-19-oxocard-20(22)-enolide chemical structure, C29H42O11

3-(Hexopyranosyloxy)-5,14-dihydroxy-19-oxocard-20(22)-enolide

C₂₉H₄₂O₁₁

Acolongifloriside K chemical structure, C29H44O12, CAS 6251-64-5

Acolongifloriside K

CAS 6251-64-5C₂₉H₄₄O₁₂

5-beta-Card-20(22)-enolide, 3-beta-((L-rhamnopyranosyl)oxy)-5,11,14,19-tetrahydroxy- chemical structure, C29H44O11, CAS 6891-94-7

5-beta-Card-20(22)-enolide, 3-beta-((L-rhamnopyranosyl)oxy)-5,11,14,19-tetrahydroxy-

CAS 6891-94-7C₂₉H₄₄O₁₁

5-beta-Card-20(22)-enolide, 3-beta-((6-deoxy-3-O-methyl-beta-D-glucopyranosyl)oxy)-5,14-dihydroxy-19-oxo- chemical structure, C30H44O10, CAS 15487-11-3

5-beta-Card-20(22)-enolide, 3-beta-((6-deoxy-3-O-methyl-beta-D-glucopyranosyl)oxy)-5,14-dihydroxy-19-oxo-

CAS 15487-11-3C₃₀H₄₄O₁₀

5,14-Dihydroxy-19-oxo-3-(pentopyranosyloxy)card-20(22)-enolide chemical structure, C28H40O10, CAS 15596-26-6

5,14-Dihydroxy-19-oxo-3-(pentopyranosyloxy)card-20(22)-enolide

CAS 15596-26-6C₂₈H₄₀O₁₀

Strophanthidol-D-glucose chemical structure, C29H44O11, CAS 16479-53-1

Strophanthidol-D-glucose

CAS 16479-53-1C₂₉H₄₄O₁₁

3-(Hexopyranosyloxy)-5,14-dihydroxycard-20(22)-enolide chemical structure, C29H44O10, CAS 18531-44-7

3-(Hexopyranosyloxy)-5,14-dihydroxycard-20(22)-enolide

CAS 18531-44-7C₂₉H₄₄O₁₀

Digoxigenin-beta-D-glucosid chemical structure, C29H44O10, CAS 25817-75-8

Digoxigenin-beta-D-glucosid

CAS 25817-75-8C₂₉H₄₄O₁₀

3-[(6-Deoxyhexopyranosyl)oxy]-14-hydroxy-19-oxocard-20(22)-enolide chemical structure, C29H42O9

3-[(6-Deoxyhexopyranosyl)oxy]-14-hydroxy-19-oxocard-20(22)-enolide

C₂₉H₄₂O₉

3-[(2,6-Dideoxy-3-O-methylhexopyranosyl)oxy]-5,14-dihydroxycard-20(22)-enolide chemical structure, C30H46O8

3-[(2,6-Dideoxy-3-O-methylhexopyranosyl)oxy]-5,14-dihydroxycard-20(22)-enolide

C₃₀H₄₆O₈

5-alpha-Card-20(22)-enolide, 3-beta-((6-deoxy-3-O-methyl-alpha-L-glucopyranosyl)oxy)-14-hydroxy- chemical structure, C30H46O8, CAS 34302-25-5

5-alpha-Card-20(22)-enolide, 3-beta-((6-deoxy-3-O-methyl-alpha-L-glucopyranosyl)oxy)-14-hydroxy-

CAS 34302-25-5C₃₀H₄₆O₈

Digitoxigenin-beta-tetraacetyl-d-glucoside chemical structure, C37H52O13, CAS 35068-75-8

Digitoxigenin-beta-tetraacetyl-d-glucoside

CAS 35068-75-8C₃₇H₅₂O₁₃

3-((2,6-Dideoxyhexopyranosyl)oxy)-16-(formyloxy)-14-hydroxycard-20(22)-enolide chemical structure, C30H44O9, CAS 11014-58-7

3-((2,6-Dideoxyhexopyranosyl)oxy)-16-(formyloxy)-14-hydroxycard-20(22)-enolide

CAS 11014-58-7C₃₀H₄₄O₉

Card-20(22)-enolide, 12,14-dihydroxy-3-((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)oxy)-, (3-beta,5-beta,12-beta)- chemical structure, C37H52O14, CAS 79317-29-6

Card-20(22)-enolide, 12,14-dihydroxy-3-((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)oxy)-, (3-beta,5-beta,12-beta)-

CAS 79317-29-6C₃₇H₅₂O₁₄

5-beta-Card-20(22)-enolide, 3-beta-((D-fucopyranosyl)oxy)-5,14-dihydroxy- chemical structure, C29H44O9, CAS 88195-69-1

5-beta-Card-20(22)-enolide, 3-beta-((D-fucopyranosyl)oxy)-5,14-dihydroxy-

CAS 88195-69-1C₂₉H₄₄O₉

3-[(2,6-Dideoxy-3-O-methylhexopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide chemical structure, C30H46O8, CAS 101310-92-3

3-[(2,6-Dideoxy-3-O-methylhexopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide

CAS 101310-92-3C₃₀H₄₆O₈

5-beta-Card-20(22)-enolide, 3-beta-((6-deoxy-3-O-methyl-beta-L-glucopyranosyl)oxy)-14-hydroxy-, 4',14-diacetate chemical structure, C34H50O10, CAS 101418-21-7

5-beta-Card-20(22)-enolide, 3-beta-((6-deoxy-3-O-methyl-beta-L-glucopyranosyl)oxy)-14-hydroxy-, 4',14-diacetate

CAS 101418-21-7C₃₄H₅₀O₁₀