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Murcko scaffold

Ring system with 5 rings and 31 atoms

11 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
31
Chemicals
11
With full pages
2
Scaffold SMILES

O=C1C=CCCOCC=CC=CC(=O)OC2CC3OC4C=CCCC4(CO1)C2C31CO1

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=CCCOCC=CC=CC(=O)OC2CC3OC4C=CCCC4(CO1)C2C31CO1

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

17-(1-Hydroxyethyl)-5,13,25-trimethylspiro[2,10,16,23-tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa-4,12,18,20-tetraene-26,2'-oxirane]-11,22-dione chemical structure, C29H38O8
17-(1-Hydroxyethyl)-5,13,25-trimethylspiro[2,10,16,23-tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa-4,12,18,20-tetraene-26,2'-oxirane]-11,22-dione
C29H38O8
Isororidin e chemical structure, C29H38O8
Isororidin e
C29H38O8
16-Hydroxyroridin E chemical structure, C29H38O9, CAS 436144-43-3
16-Hydroxyroridin E
CAS 436144-43-3C29H38O9
Verrucarin A, 2',3'-didehydro-7'-deoxo-2'-deoxy-7'-(1-hydroxyethyl)-, (2'E,7'S(R))- chemical structure, C29H38O8
Verrucarin A, 2',3'-didehydro-7'-deoxo-2'-deoxy-7'-(1-hydroxyethyl)-, (2'E,7'S(R))-
C29H38O8
Roridin E acetate chemical structure, C31H40O9, CAS 32656-18-1
Roridin E acetate
CAS 32656-18-1C31H40O9
Roridin E chemical structure, C29H38O8, CAS 16891-85-3
Roridin E
CAS 16891-85-3C29H38O8
Myotoxin A chemical structure, C29H38O9, CAS 90790-03-7
Myotoxin A
CAS 90790-03-7C29H38O9
Isororidin-E chemical structure, C29H38O8, CAS 64726-84-7
Isororidin-E
CAS 64726-84-7C29H38O8
(1R,3R,8R,17S,20Z,24R,25S,26S)-17-[(1S)-1-Hydroxyethyl]-5,13,25-trimethylspiro[2,10,16,23-tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa-4,12,18,20-tetraene-26,2'-oxirane]-11,22-dione chemical structure, C29H38O8
(1R,3R,8R,17S,20Z,24R,25S,26S)-17-[(1S)-1-Hydroxyethyl]-5,13,25-trimethylspiro[2,10,16,23-tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa-4,12,18,20-tetraene-26,2'-oxirane]-11,22-dione
C29H38O8
Roridin L chemical structure, C29H38O9, CAS 390410-20-5
Roridin L
CAS 390410-20-5C29H38O9
Epiisororidin E chemical structure, C29H38O8, CAS 249744-12-5
Epiisororidin E
CAS 249744-12-5C29H38O8