CompoundList
Sign in
Murcko scaffold

Benzo[a]pyrene scaffold

209 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
20
Chemicals
209
With full pages
41
Scaffold SMILES

c1ccc2c(c1)cc1ccc3cccc4ccc2c1c34

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 scaffoldOpen the Benzo[a]pyrene page
Murcko scaffold c1ccc2c(c1)cc1ccc3cccc4ccc2c1c34

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 209 chemicals

Benzo[a]pyrene chemical structure, C20H12, CAS 50-32-8
Benzo[a]pyrene
CAS 50-32-8C20H12
6-Methylbenzo(a)pyrene chemical structure, C21H14, CAS 2381-39-7
6-Methylbenzo(a)pyrene
CAS 2381-39-7C21H14
12-Methylbenzo[a]pyrene chemical structure, C21H14, CAS 4514-19-6
12-Methylbenzo[a]pyrene
CAS 4514-19-6C21H14
6-Aminobenzo(a)pyrene chemical structure, C20H13N, CAS 7428-83-3
6-Aminobenzo(a)pyrene
CAS 7428-83-3C20H13N
Benzo(a)pyrene-6-carboxaldehyde chemical structure, C21H12O, CAS 13312-42-0
Benzo(a)pyrene-6-carboxaldehyde
CAS 13312-42-0C21H12O
3-Hydroxybenzo(a)pyrene chemical structure, C20H12O, CAS 13345-21-6
3-Hydroxybenzo(a)pyrene
CAS 13345-21-6C20H12O
1-Hydroxybenzo(a)pyrene chemical structure, C20H12O, CAS 13345-23-8
1-Hydroxybenzo(a)pyrene
CAS 13345-23-8C20H12O
8-Hydroxybenzo[a]pyrene chemical structure, C20H12O, CAS 13345-26-1
8-Hydroxybenzo[a]pyrene
CAS 13345-26-1C20H12O
Benzo(a)pyrene, 11-methyl- chemical structure, C21H14, CAS 16757-80-5
Benzo(a)pyrene, 11-methyl-
CAS 16757-80-5C21H14
3-Methylbenzo(a)pyrene chemical structure, C21H14, CAS 16757-81-6
3-Methylbenzo(a)pyrene
CAS 16757-81-6C21H14
2-Methylbenzo[a]pyrene chemical structure, C21H14, CAS 16757-82-7
2-Methylbenzo[a]pyrene
CAS 16757-82-7C21H14
4-Methylbenzo[a]pyrene chemical structure, C21H14, CAS 16757-83-8
4-Methylbenzo[a]pyrene
CAS 16757-83-8C21H14
Benzo(a)pyrene, 3,12-dimethyl- chemical structure, C22H16, CAS 16757-84-9
Benzo(a)pyrene, 3,12-dimethyl-
CAS 16757-84-9C22H16
Benzo(a)pyrene, 1,2-dimethyl- chemical structure, C22H16, CAS 16757-85-0
Benzo(a)pyrene, 1,2-dimethyl-
CAS 16757-85-0C22H16
1,3-Dimethylbenzo[a]pyrene chemical structure, C22H16, CAS 16757-86-1
1,3-Dimethylbenzo[a]pyrene
CAS 16757-86-1C22H16
2,3-Dimethylbenzo[a]pyrene chemical structure, C22H16, CAS 16757-87-2
2,3-Dimethylbenzo[a]pyrene
CAS 16757-87-2C22H16
1,4-Dimethylbenzo[a]pyrene chemical structure, C22H16, CAS 16757-88-3
1,4-Dimethylbenzo[a]pyrene
CAS 16757-88-3C22H16
Benzo(a)pyrene, 4,5-dimethyl- chemical structure, C22H16, CAS 16757-89-4
Benzo(a)pyrene, 4,5-dimethyl-
CAS 16757-89-4C22H16
Benzo(a)pyrene, 1,6-dimethyl- chemical structure, C22H16, CAS 16757-90-7
Benzo(a)pyrene, 1,6-dimethyl-
CAS 16757-90-7C22H16
3,6-Dimethylbenzo[a]pyrene chemical structure, C22H16, CAS 16757-91-8
3,6-Dimethylbenzo[a]pyrene
CAS 16757-91-8C22H16
Benzo(a)pyrene, 1,3,6-trimethyl- chemical structure, C23H18, CAS 16757-92-9
Benzo(a)pyrene, 1,3,6-trimethyl-
CAS 16757-92-9C23H18
9-Hydroxybenzo(a)pyrene chemical structure, C20H12O, CAS 17573-21-6
9-Hydroxybenzo(a)pyrene
CAS 17573-21-6C20H12O
Benzo(a)pyrene-6-methanol chemical structure, C21H14O, CAS 21247-98-3
Benzo(a)pyrene-6-methanol
CAS 21247-98-3C21H14O
6-Bromobenzo(a)pyrene chemical structure, C20H11Br, CAS 21248-00-0
6-Bromobenzo(a)pyrene
CAS 21248-00-0C20H11Br