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Murcko scaffold

Ring system with 3 rings and 29 atoms

37 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 29
Chemicals: 37
With full pages: 8

Scaffold SMILES

O=C(CCc1ccccc1)NCC(=O)NC(Cc1cnc[nH]1)C(=O)N1CCCC1

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(CCc1ccccc1)NCC(=O)NC(Cc1cnc[nH]1)C(=O)N1CCCC1

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 37 of 37 chemicals

Angiotensin-(1-7) chemical structure, C41H62N12O11, CAS 51833-78-4

Angiotensin-(1-7)

CAS 51833-78-4C₄₁H₆₂N₁₂O₁₁

Angiotensin II (3-7) chemical structure, C31H45N7O7, CAS 122483-84-5

Angiotensin II (3-7)

CAS 122483-84-5C₃₁H₄₅N₇O₇

Angiotensin II, sar(1)-val(5)-ile(8)- chemical structure, C45H71N13O10, CAS 51274-63-6

Angiotensin II, sar(1)-val(5)-ile(8)-

CAS 51274-63-6C₄₅H₇₁N₁₃O₁₀

Angiotensin II, N-(1-octanoyl)-ile(5)-leu(8)- chemical structure, C59H95N13O17, CAS 62854-22-2

Angiotensin II, N-(1-octanoyl)-ile(5)-leu(8)-

CAS 62854-22-2C₅₉H₉₅N₁₃O₁₇

Angiotensin III, Sar(1)-Ile(7)- chemical structure, C40H61N9O9, CAS 116331-58-9

Angiotensin III, Sar(1)-Ile(7)-

CAS 116331-58-9C₄₀H₆₁N₉O₉

Angiotensin II, Sar(1)-Phe(4)-Ile(8)- chemical structure, C46H73N13O9, CAS 98641-01-1

Angiotensin II, Sar(1)-Phe(4)-Ile(8)-

CAS 98641-01-1C₄₆H₇₃N₁₃O₉

Angiotensin II, sar(1)-aza-val(3)-ile(8)- chemical structure, C44H70N14O10, CAS 116370-31-1

Angiotensin II, sar(1)-aza-val(3)-ile(8)-

CAS 116370-31-1C₄₄H₇₀N₁₄O₁₀

Trv-120027 chemical structure, C43H67N13O10, CAS 1234510-46-3

CAS 1234510-46-3C₄₃H₆₇N₁₃O₁₀

Angiotensin II, 1-hydantoic acid-Val(5)-Ala(8)- chemical structure, C42H64N14O11, CAS 58630-48-1

Angiotensin II, 1-hydantoic acid-Val(5)-Ala(8)-

CAS 58630-48-1C₄₂H₆₄N₁₄O₁₁

Angiotensin II, ala(8)- chemical structure, C44H67N13O12, CAS 18197-01-8

Angiotensin II, ala(8)-

CAS 18197-01-8C₄₄H₆₇N₁₃O₁₂

Angiotensin II, 1-Sar-5-Ile-8-Ala- chemical structure, C43H67N13O10, CAS 38027-95-1

Angiotensin II, 1-Sar-5-Ile-8-Ala-

CAS 38027-95-1C₄₃H₆₇N₁₃O₁₀

Saralasin chemical structure, C42H65N13O10, CAS 34273-10-4

CAS 34273-10-4C₄₂H₆₅N₁₃O₁₀

Aclerastide chemical structure, C42H64N12O11, CAS 227803-63-6

CAS 227803-63-6C₄₂H₆₄N₁₂O₁₁

(Sar1,ile8)-angiotensin II chemical structure, C46H73N13O10, CAS 37827-06-8

(Sar1,ile8)-angiotensin II

CAS 37827-06-8C₄₆H₇₃N₁₃O₁₀

(D-Pro7)-angiotensin I/II (1-7) chemical structure, C41H62N12O11, CAS 586962-44-9

(D-Pro7)-angiotensin I/II (1-7)

CAS 586962-44-9C₄₁H₆₂N₁₂O₁₁

H-Ser-Thr-Phe-Thr-His-Pro-Arg-OH chemical structure, C37H56N12O11, CAS 683750-69-8

H-Ser-Thr-Phe-Thr-His-Pro-Arg-OH

CAS 683750-69-8C₃₇H₅₆N₁₂O₁₁

(2S)-1-[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-(Diaminomethylideneamino)-2-[[2-(methylamino)acetyl]amino]pentanoyl]amino]-3-methylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carboxamide chemical structure, C40H63N13O8, CAS 126112-22-9

(2S)-1-[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-(Diaminomethylideneamino)-2-[[2-(methylamino)acetyl]amino]pentanoyl]amino]-3-methylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carboxamide

CAS 126112-22-9C₄₀H₆₃N₁₃O₈

Orb1690541 chemical structure, C43H65N13O12, CAS 40678-47-5

CAS 40678-47-5C₄₃H₆₅N₁₃O₁₂

Saralasin acetate chemical structure, C44H71N13O13, CAS 39698-78-7

Saralasin acetate

CAS 39698-78-7C₄₄H₇₁N₁₃O₁₃

Sar-Arg-Val-Tyr-Ile-His-Pro-Ile chemical structure, C46H73N13O10, CAS 67724-27-0

Sar-Arg-Val-Tyr-Ile-His-Pro-Ile

CAS 67724-27-0C₄₆H₇₃N₁₃O₁₀

Angiotensin III, ile(7)- chemical structure, C43H68N12O9, CAS 52498-25-6

Angiotensin III, ile(7)-

CAS 52498-25-6C₄₃H₆₈N₁₂O₉

(Asn1,val5,ala8)angiotensin II chemical structure, C43H66N14O11, CAS 32475-95-9

(Asn1,val5,ala8)angiotensin II

CAS 32475-95-9C₄₃H₆₆N₁₄O₁₁

Saralasin acetate anhydrous chemical structure, C44H69N13O12, CAS 54194-01-3

Saralasin acetate anhydrous

CAS 54194-01-3C₄₄H₆₉N₁₃O₁₂

Sar-Arg-Val-Tyr-Ile-His-Pro-Ala chemical structure, C45H71N13O12, CAS 53935-10-7

Sar-Arg-Val-Tyr-Ile-His-Pro-Ala

CAS 53935-10-7C₄₅H₇₁N₁₃O₁₂