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Murcko scaffold

Ring system with 6 rings and 33 atoms

31 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
33
Chemicals
31
With full pages
4
Scaffold SMILES

O=C1c2ccccc2C(=O)c2cc3c(cc21)CCCC3OC1CC(N2CCOCC2)CCO1

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=C1c2ccccc2C(=O)c2cc3c(cc21)CCCC3OC1CC(N2CCOCC2)CCO1

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 31 of 31 chemicals

Nemorubicin chemical structure, C32H37NO13, CAS 108852-90-0
Nemorubicin
CAS 108852-90-0C32H37NO13
Morpholinodoxorubicin chemical structure, C31H35NO12, CAS 80790-68-7
Morpholinodoxorubicin
CAS 80790-68-7C31H35NO12
3'-(4-Morpholinyl)-3'-deaminodaunorubicin chemical structure, C31H35NO11, CAS 79867-78-0
3'-(4-Morpholinyl)-3'-deaminodaunorubicin
CAS 79867-78-0C31H35NO11
5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(1-hydroxyethyl)-1-methoxy-10-((2,3,6-trideoxy-3-(4-morpholinyl)-alpha-L-lyxo-hexopyranosyl)oxy)-, hydrochloride chemical structure, C31H38ClNO11, CAS 79951-58-9
5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(1-hydroxyethyl)-1-methoxy-10-((2,3,6-trideoxy-3-(4-morpholinyl)-alpha-L-lyxo-hexopyranosyl)oxy)-, hydrochloride
CAS 79951-58-9C31H38ClNO11
4-[6-[(3-Acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyloxan-4-yl]morpholine-3-carbonitrile chemical structure, C32H34N2O11, CAS 94730-47-9
4-[6-[(3-Acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyloxan-4-yl]morpholine-3-carbonitrile
CAS 94730-47-9C32H34N2O11
Cyanomorpholinoadriamycin chemical structure, C32H34N2O12, CAS 94730-48-0
Cyanomorpholinoadriamycin
CAS 94730-48-0C32H34N2O12
Antibiotic MX 2 chemical structure, C30H35NO11
Antibiotic MX 2
C30H35NO11
3'-Deamino-3'-(4-morpholinyl)daunorubicin hydrobromide chemical structure, C31H36BrNO11, CAS 79898-07-0
3'-Deamino-3'-(4-morpholinyl)daunorubicin hydrobromide
CAS 79898-07-0C31H36BrNO11
3'-Deamino-3'-(4-morpholinyl)-13-dihydro-adriamycin hydrocholoride dihydrate chemical structure, C31H38ClNO12, CAS 80787-27-5
3'-Deamino-3'-(4-morpholinyl)-13-dihydro-adriamycin hydrocholoride dihydrate
CAS 80787-27-5C31H38ClNO12
3'-Deamino-3'-(4-morpholinyl)-13-dihydro-adriamycin hydrocholoridedihydrate chemical structure, C31H37NO12, CAS 80875-73-6
3'-Deamino-3'-(4-morpholinyl)-13-dihydro-adriamycin hydrocholoridedihydrate
CAS 80875-73-6C31H37NO12
5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(1-hydroxyethyl)-1-methoxy-10-((2,3,6-trideoxy-3-(4-morpholinyl)-alpha-L-lyxo-hexopyranosyl)oxy)- chemical structure, C31H37NO11, CAS 79867-79-1
5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(1-hydroxyethyl)-1-methoxy-10-((2,3,6-trideoxy-3-(4-morpholinyl)-alpha-L-lyxo-hexopyranosyl)oxy)-
CAS 79867-79-1C31H37NO11
Morpholinoanthracycline MX chemical structure, C30H35NO10, CAS 105026-49-1
Morpholinoanthracycline MX
CAS 105026-49-1C30H35NO10
Morpholinoanthracycline MY5 chemical structure, C30H35NO9, CAS 105026-51-5
Morpholinoanthracycline MY5
CAS 105026-51-5C30H35NO9
9-Ethyl-6,9,11-trihydroxy-7-(5-hydroxy-6-methyl-4-morpholin-4-yloxan-2-yl)oxy-8,10-dihydro-7H-tetracene-5,12-dione chemical structure, C30H35NO9, CAS 132098-65-8
9-Ethyl-6,9,11-trihydroxy-7-(5-hydroxy-6-methyl-4-morpholin-4-yloxan-2-yl)oxy-8,10-dihydro-7H-tetracene-5,12-dione
CAS 132098-65-8C30H35NO9
alpha-3'-Deamino-3'-(3-cyano-4-morphgolinyl)-13-dihydrodaunomycin chemical structure, C32H36N2O11, CAS 89164-75-0
alpha-3'-Deamino-3'-(3-cyano-4-morphgolinyl)-13-dihydrodaunomycin
CAS 89164-75-0C32H36N2O11
alpha-3'-Deamino-3'-(3-cyano-4-morpholinyl)-13-dihydroadriamycin chemical structure, C32H36N2O12, CAS 89164-77-2
alpha-3'-Deamino-3'-(3-cyano-4-morpholinyl)-13-dihydroadriamycin
CAS 89164-77-2C32H36N2O12
Morpholinodoxorubicin hydrochloride chemical structure, C31H36ClNO12, CAS 89196-04-3
Morpholinodoxorubicin hydrochloride
CAS 89196-04-3C31H36ClNO12
beta-3'-Deamino-3'-(3-cyano-4-morpholinyl)daunomycin chemical structure, C32H34N2O11, CAS 89196-06-5
beta-3'-Deamino-3'-(3-cyano-4-morpholinyl)daunomycin
CAS 89196-06-5C32H34N2O11
Cyanomorpholino doxorubicin chemical structure, C32H34N2O12, CAS 88254-07-3
Cyanomorpholino doxorubicin
CAS 88254-07-3C32H34N2O12
MX2 hydrochloride chemical structure, C30H36ClNO11, CAS 131722-57-1
MX2 hydrochloride
CAS 131722-57-1C30H36ClNO11
3'-Deamino-3'-(4-morpholinyl)daunmycin HCl chemical structure, C31H35NO11, CAS 80844-67-3
3'-Deamino-3'-(4-morpholinyl)daunmycin HCl
CAS 80844-67-3C31H35NO11
alpha-3'-Deamino-3'-(3-cyano-4-morpholinyl)adriamycin chemical structure, C32H34N2O12, CAS 89196-07-6
alpha-3'-Deamino-3'-(3-cyano-4-morpholinyl)adriamycin
CAS 89196-07-6C32H34N2O12
Krn-8602 free base chemical structure, C30H35NO11, CAS 105026-50-4
Krn-8602 free base
CAS 105026-50-4C30H35NO11
Nemorubicin hydrochloride chemical structure, C32H38ClNO13, CAS 108943-08-4
Nemorubicin hydrochloride
CAS 108943-08-4C32H38ClNO13