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Murcko scaffold

Ring system with 3 rings and 32 atoms

10 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
32
Chemicals
10
With full pages
3
Scaffold SMILES

O=C1CCC=CC=CCNC(=O)C=CCCOC(=O)C2CCCN2C(=O)c2coc(n2)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=C1CCC=CC=CCNC(=O)C=CCCOC(=O)C2CCCN2C(=O)c2coc(n2)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 10 of 10 chemicals

Dalfopristin chemical structure, C34H50N4O9S, CAS 112362-50-2
Dalfopristin
CAS 112362-50-2C34H50N4O9S
Virginiamycin M chemical structure, C28H37N3O7, CAS 9040-13-5
Virginiamycin M
CAS 9040-13-5C28H37N3O7
Volpristin chemical structure, C28H37N3O7, CAS 21102-49-8
Volpristin
CAS 21102-49-8C28H37N3O7
(12Z,17Z,19Z)-21-Hydroxy-11,19-dimethyl-10-propan-2-yl-9,26-dioxa-3,15,28-triazatricyclo[23.2.1.03,7]octacosa-1(27),12,17,19,25(28)-pentaene-2,8,14,23-tetrone chemical structure, C28H37N3O7
(12Z,17Z,19Z)-21-Hydroxy-11,19-dimethyl-10-propan-2-yl-9,26-dioxa-3,15,28-triazatricyclo[23.2.1.03,7]octacosa-1(27),12,17,19,25(28)-pentaene-2,8,14,23-tetrone
C28H37N3O7
Volpristin chemical structure, C28H37N3O7
Volpristin
C28H37N3O7
(-)-Virginiamycin M2 chemical structure, C28H37N3O7
(-)-Virginiamycin M2
C28H37N3O7
(6R,7S,11R,12E,17E,19E,21S)-6-[2-(Diethylamino)ethylsulfonyl]-21-hydroxy-11,19-dimethyl-10-propan-2-yl-9,26-dioxa-3,15,28-triazatricyclo[23.2.1.03,7]octacosa-1(27),12,17,19,25(28)-pentaene-2,8,14,23-tetrone chemical structure, C34H50N4O9S, CAS 2743429-97-0
(6R,7S,11R,12E,17E,19E,21S)-6-[2-(Diethylamino)ethylsulfonyl]-21-hydroxy-11,19-dimethyl-10-propan-2-yl-9,26-dioxa-3,15,28-triazatricyclo[23.2.1.03,7]octacosa-1(27),12,17,19,25(28)-pentaene-2,8,14,23-tetrone
CAS 2743429-97-0C34H50N4O9S
Pristinamycin B chemical structure, C28H37N3O7
Pristinamycin B
C28H37N3O7
Virginiamycin S chemical structure, C62H85N7O16S, CAS 9040-14-6
Virginiamycin S
CAS 9040-14-6C62H85N7O16S
3H-21,18-Nitrilo-1H,22H-pyrrolo[2,1-c][1,8,4,19]dioxadiazacyclotetracosine-1,7,16,22(4H,17H)-tetrone, 26-[[2-(diethylamino)ethyl]thio]-8,9,14,15,24,25,26,26a-octahydro-14-hydroxy-4,12-dimethyl-3-(1-methylethyl)-, (3R,4R,5E,10E,12E,14S,26R,26aS)- chemical structure, C34H50N4O7S, CAS 112421-05-3
3H-21,18-Nitrilo-1H,22H-pyrrolo[2,1-c][1,8,4,19]dioxadiazacyclotetracosine-1,7,16,22(4H,17H)-tetrone, 26-[[2-(diethylamino)ethyl]thio]-8,9,14,15,24,25,26,26a-octahydro-14-hydroxy-4,12-dimethyl-3-(1-methylethyl)-, (3R,4R,5E,10E,12E,14S,26R,26aS)-
CAS 112421-05-3C34H50N4O7S