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Murcko scaffold

Ring system with 3 rings and 13 atoms

21 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 13
Chemicals: 21
With full pages: 4

Scaffold SMILES

c1ccc2c(c1)CC1CCCC1C2

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 c1ccc2c(c1)CC1CCCC1C2

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 21 of 21 chemicals

Treprostinil impurity 19 chemical structure, C23H34O5, CAS 112421-28-0

Treprostinil impurity 19

CAS 112421-28-0C₂₃H₃₄O₅

1H-Benzindene, hexahydrodimethyl- chemical structure, C15H20, CAS 68954-04-1

1H-Benzindene, hexahydrodimethyl-

CAS 68954-04-1C₁₅H₂₀

Treprostinil chemical structure, C23H34O5, CAS 81846-19-7

CAS 81846-19-7C₂₃H₃₄O₅

Treprostinil impurity 2 chemical structure, C22H34O3, CAS 101692-01-7

Treprostinil impurity 2

CAS 101692-01-7C₂₂H₃₄O₃

Descarboxymethyl treprostinil chemical structure, C21H32O3, CAS 101692-02-8

Descarboxymethyl treprostinil

CAS 101692-02-8C₂₁H₃₂O₃

Treprostinil diolamine chemical structure, C27H45NO7, CAS 830354-48-8

Treprostinil diolamine

CAS 830354-48-8C₂₇H₄₅NO₇

1-(3-Hydroxyoctyl)-5-methoxy-2,3,3a,4,9,9a-hexahydro-1H-cyclopenta[b]naphthalen-2-ol chemical structure, C22H34O3

1-(3-Hydroxyoctyl)-5-methoxy-2,3,3a,4,9,9a-hexahydro-1H-cyclopenta[b]naphthalen-2-ol

C₂₂H₃₄O₃

(3R)-Treprostinil chemical structure, C23H34O5, CAS 343247-13-2

(3R)-Treprostinil

CAS 343247-13-2C₂₃H₃₄O₅

Treprestinil methyl ester chemical structure, C24H36O5, CAS 81845-98-9

Treprestinil methyl ester

CAS 81845-98-9C₂₄H₃₆O₅

Acetic acid, 2-(((1R,2R,3aS,9aS)-2,3,3a,4,9,9a-hexahydro-2-hydroxy-1-((3S)-3-hydroxyoctyl)-1H-benz(f)inden-5-yl)oxy)-, sodium salt (1:1) chemical structure, C23H34NaO5, CAS 289480-64-4

Acetic acid, 2-(((1R,2R,3aS,9aS)-2,3,3a,4,9,9a-hexahydro-2-hydroxy-1-((3S)-3-hydroxyoctyl)-1H-benz(f)inden-5-yl)oxy)-, sodium salt (1:1)

CAS 289480-64-4C₂₃H₃₄NaO₅

Treprostinil ethyl ester chemical structure, C25H38O5, CAS 1355990-07-6

Treprostinil ethyl ester

CAS 1355990-07-6C₂₅H₃₈O₅

Treprostinil palmitil chemical structure, C39H66O5, CAS 1706528-83-7

Treprostinil palmitil

CAS 1706528-83-7C₃₉H₆₆O₅

NJ3Mmp9ekd chemical structure, C26H40O5, CAS 2714564-05-1

CAS 2714564-05-1C₂₆H₄₀O₅

Treprostinil-d9 chemical structure, C23H34O5, CAS 2747918-14-3

Treprostinil-d9

CAS 2747918-14-3C₂₃H₃₄O₅

Descarboxy treprostinil chemical structure, C22H34O3

Descarboxy treprostinil

C₂₂H₃₄O₃

Treprostinil glycolamide chemical structure, C25H37NO6, CAS 2101947-03-7

Treprostinil glycolamide

CAS 2101947-03-7C₂₅H₃₇NO₆

Treprostinil bisphosphate chemical structure, C23H36O11P2, CAS 830354-49-9

Treprostinil bisphosphate

CAS 830354-49-9C₂₃H₃₆O₁₁P₂

Treprostinil enantiomer chemical structure, C23H34O5, CAS 1911575-29-5

Treprostinil enantiomer

CAS 1911575-29-5C₂₃H₃₄O₅

Acetonitrile, 2-[[(1R,2R,3aS,9aS)-2,3,3a,4,9,9a-hexahydro-2-hydroxy-1-[(3R)-3-hydroxyhexyl]-1H-benz[f]inden-5-yl]oxy]-, rel- chemical structure, C21H29NO3, CAS 1332605-93-2

Acetonitrile, 2-[[(1R,2R,3aS,9aS)-2,3,3a,4,9,9a-hexahydro-2-hydroxy-1-[(3R)-3-hydroxyhexyl]-1H-benz[f]inden-5-yl]oxy]-, rel-

CAS 1332605-93-2C₂₁H₂₉NO₃

Treprostinil sodium hexahydrate chemical structure, C23H45NaO11, CAS 2377168-44-8

Treprostinil sodium hexahydrate

CAS 2377168-44-8C₂₃H₄₅NaO₁₁

Treprostinil impurity A chemical structure, C27H43NO6, CAS 1345337-82-7

Treprostinil impurity A

CAS 1345337-82-7C₂₇H₄₃NO₆