CompoundList
Sign in
Murcko scaffold

Ring system with 7 rings and 19 atoms

69 chemicals on CompoundList share this ring system.

Rings
7
Scaffold atoms
19
Chemicals
69
With full pages
9
Scaffold SMILES

c1ccc2c(c1)NC1C3CC4CCN3C3CC21CC43

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)NC1C3CC4CCN3C3CC21CC43

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 48 of 69 chemicals

Aritmina chemical structure, C20H26N2O2, CAS 860214-04-6
Aritmina
CAS 860214-04-6C20H26N2O2
Bis(monochloroacetyl)ajmaline chemical structure, C24H29Cl3N2O4, CAS 2552-89-8
Bis(monochloroacetyl)ajmaline
CAS 2552-89-8C24H29Cl3N2O4
Dichloroacetylajmaline chemical structure, C24H28Cl2N2O4, CAS 2800-66-0
Dichloroacetylajmaline
CAS 2800-66-0C24H28Cl2N2O4
Ajmalinium, N(sup 4)-propyl-, bromide chemical structure, C23H33BrN2O2, CAS 14046-99-2
Ajmalinium, N(sup 4)-propyl-, bromide
CAS 14046-99-2C23H33BrN2O2
Ajmaline phenylbarbiturate chemical structure, C30H34N4O5, CAS 81424-61-5
Ajmaline phenylbarbiturate
CAS 81424-61-5C30H34N4O5
Ajmaline-17-ol, monochloroacetate, hydrochloride chemical structure, C22H28Cl2N2O3, CAS 31081-68-2
Ajmaline-17-ol, monochloroacetate, hydrochloride
CAS 31081-68-2C22H28Cl2N2O3
L-Aspartic acid, compd. with (17R,21-alpha)-ajmalan-17,21-diol (1:1) chemical structure, C24H33N3O6, CAS 94135-18-9
L-Aspartic acid, compd. with (17R,21-alpha)-ajmalan-17,21-diol (1:1)
CAS 94135-18-9C24H33N3O6
Ajmalinium, N-methyl-, iodide chemical structure, C21H29IN2O2, CAS 21451-45-6
Ajmalinium, N-methyl-, iodide
CAS 21451-45-6C21H29IN2O2
Ajmalan-17,21-diol, 1-demethyl-, dihydrochloride, (17R,21-alpha)- chemical structure, C19H26Cl2N2O2, CAS 23944-26-5
Ajmalan-17,21-diol, 1-demethyl-, dihydrochloride, (17R,21-alpha)-
CAS 23944-26-5C19H26Cl2N2O2
Isoajmaline chemical structure, C20H26N2O2
Isoajmaline
C20H26N2O2
Ajmalan-17,21-diol--methanol (1/1) chemical structure, C21H30N2O3, CAS 61018-01-7
Ajmalan-17,21-diol--methanol (1/1)
CAS 61018-01-7C21H30N2O3
Ajmalanium, 17,21-dihydroxy-4-(2-hydroxy-3-methoxypropyl)-, (17R,21-alpha)- chemical structure, C24H35N2O4+, CAS 58892-89-0
Ajmalanium, 17,21-dihydroxy-4-(2-hydroxy-3-methoxypropyl)-, (17R,21-alpha)-
CAS 58892-89-0C24H35N2O4+
Ajmalanium, 17,21-dihydroxy-4-(3-ethoxy-2-hydroxypropyl)-, (17R,21-alpha)- chemical structure, C25H37N2O4+, CAS 58892-90-3
Ajmalanium, 17,21-dihydroxy-4-(3-ethoxy-2-hydroxypropyl)-, (17R,21-alpha)-
CAS 58892-90-3C25H37N2O4+
Ajmalanium, 17,21-dihydroxy-4-(2-hydroxy-3-propoxypropyl)-, (17R,21-alpha)- chemical structure, C26H39N2O4+, CAS 58892-91-4
Ajmalanium, 17,21-dihydroxy-4-(2-hydroxy-3-propoxypropyl)-, (17R,21-alpha)-
CAS 58892-91-4C26H39N2O4+
Ajmalanium, 4-(3-butoxy-2-hydroxypropyl)-17,21-dihydroxy-, (17R,21-alpha)- chemical structure, C27H41N2O4+, CAS 58892-92-5
Ajmalanium, 4-(3-butoxy-2-hydroxypropyl)-17,21-dihydroxy-, (17R,21-alpha)-
CAS 58892-92-5C27H41N2O4+
Ajmalanium, 4-(2-(diethylamino)ethyl)-17,21-dihydroxy-, (17R,21-alpha)- chemical structure, C26H40N3O2+, CAS 58912-78-0
Ajmalanium, 4-(2-(diethylamino)ethyl)-17,21-dihydroxy-, (17R,21-alpha)-
CAS 58912-78-0C26H40N3O2+
Ajmalan-17,21-diol, 4-oxide, (17R,21-alpha)- chemical structure, C20H26N2O3, CAS 68622-80-0
Ajmalan-17,21-diol, 4-oxide, (17R,21-alpha)-
CAS 68622-80-0C20H26N2O3
Ajmalan-17,21-diol, 10-bromo-, (17S,21-alpha)-, (R-(R*,R*))-2,3-dihydroxybutanedioate(1:1) (salt) chemical structure, C24H31BrN2O8, CAS 78744-56-6
Ajmalan-17,21-diol, 10-bromo-, (17S,21-alpha)-, (R-(R*,R*))-2,3-dihydroxybutanedioate(1:1) (salt)
CAS 78744-56-6C24H31BrN2O8
Ajmalan-17,21-diol, 10-bromo-, (17S,20-alpha,21-beta)-, (R-(R*,R*))-2,3-dihydroxybutanedioate(1:1) (salt) chemical structure, C24H31BrN2O8, CAS 78781-36-9
Ajmalan-17,21-diol, 10-bromo-, (17S,20-alpha,21-beta)-, (R-(R*,R*))-2,3-dihydroxybutanedioate(1:1) (salt)
CAS 78781-36-9C24H31BrN2O8
Ajmalanium, 10-bromo-17,21-dihydroxy-4-methyl-, (17R,21-alpha)-, salt with (R-(R*,R*))-2,3-dihydroxybutanedioic acid (1:1) chemical structure, C25H33BrN2O8, CAS 79731-83-2
Ajmalanium, 10-bromo-17,21-dihydroxy-4-methyl-, (17R,21-alpha)-, salt with (R-(R*,R*))-2,3-dihydroxybutanedioic acid (1:1)
CAS 79731-83-2C25H33BrN2O8
Ajmalanium, 10-bromo-17,21-dihydroxy-4-propyl-, (17R,21-alpha)-, salt with (R-(R*,R*))-2,3-dihydroxybutanedioic acid (1:1) chemical structure, C27H37BrN2O8, CAS 79731-87-6
Ajmalanium, 10-bromo-17,21-dihydroxy-4-propyl-, (17R,21-alpha)-, salt with (R-(R*,R*))-2,3-dihydroxybutanedioic acid (1:1)
CAS 79731-87-6C27H37BrN2O8
10-Bromo-17,21-dihydroxy-4-propylajmalan-4-ium 3-carboxy-2,3-dihydroxypropanoate chemical structure, C27H37BrN2O8, CAS 79731-89-8
10-Bromo-17,21-dihydroxy-4-propylajmalan-4-ium 3-carboxy-2,3-dihydroxypropanoate
CAS 79731-89-8C27H37BrN2O8
10-Bromo-4-hexyl-17,21-dihydroxyajmalan-4-ium chemical structure, C26H38BrN2O2+, CAS 79731-93-4
10-Bromo-4-hexyl-17,21-dihydroxyajmalan-4-ium
CAS 79731-93-4C26H38BrN2O2+
10-Bromo-4-hexyl-17,21-dihydroxyajmalan-4-ium 3-carboxy-2,3-dihydroxypropanoate chemical structure, C30H43BrN2O8, CAS 79733-05-4
10-Bromo-4-hexyl-17,21-dihydroxyajmalan-4-ium 3-carboxy-2,3-dihydroxypropanoate
CAS 79733-05-4C30H43BrN2O8