Murcko scaffold
Ring system with 2 rings and 32 atoms
19 chemicals on CompoundList share this ring system.
- Rings
- 2
- Scaffold atoms
- 32
- Chemicals
- 19
- With full pages
- 4
Scaffold SMILES
O=C1C=C(C=CC=CC=CC=CC=CC=CC=CC=CC=CC2=CC(=O)CCC2)CCC1
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.
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 19 of 19 chemicals
Astaxanthin
CAS 472-61-7C40H52O4
Canthaxanthin
CAS 514-78-3C40H52O2
3,3'-Dihydroxy-beta,beta-carotene-4,4'-dione
CAS 7542-45-2C40H52O4
Phenoro
CAS 54650-04-3C80H108O2
Orb3173179
CAS 101915-55-3C40H52O2
Orb3141805
CAS 101915-56-4C40H52O2
Astaxanthin, (R,R)-
CAS 60760-95-4C40H52O4
meso-Astaxanthin
CAS 71772-51-5C40H52O4
Phoenicoxanthin
CAS 4418-72-8C40H52O3
Tilefishxanthin III
CAS 70858-54-7C40H52O4
RefChem:389574
CAS 25494-88-6C44H56O6
2-Hydroxycanthaxanthin
CAS 100485-10-7C40H52O3
Astaxanthin, (9Z)-
CAS 113085-04-4C40H52O4
Astaxanthin, (13Z)-
CAS 113085-05-5C40H52O4
Astaxanthin dipalmitate
CAS 112421-21-3C72H112O6
Astaxanthin monopalmitate
CAS 123159-02-4C56H82O5
Astaxanthin dipalmitate
C72H112O6
Astaxanthin dimethylsuccinate
CAS 578006-46-9C50H64O10
Astaxanthin dipalmitate
C72H112O6
Related scaffolds
Same ring framework with different atoms or bond orders
C(=CC=CC=CC=CC=CC1=CCCCC1)C=CC=CC=CC=CC1=CCCCC111 chemicals
C(=CC=CC=CC=CC=CC1C=CCCC1)C=CC=CC=CC=CC1=CCCCC15 chemicals
O=C1C=C(C=CC=CC=CC=CC=CC=CC=CC=CC=CC2=CCCCC2)CCC14 chemicals
C(=CC=CC=CC=CC=Cc1ccccc1)C=CC=CC=CC=Cc1ccccc12 chemicals
O=C(CCc1ccccc1)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCCc1ccccc12 chemicals
C(=CC=CC=CC=CC=CC1C=CCCC1)C=CC=CC=CC=CC1C=CCCC12 chemicals
O=C(C=CC=CC=CC=CC=CC=CC=C1CCCCC1)C=CC=CC1CCCCC11 chemical
O=C1C=C(C=CC=CC=CC=CC=CC=CC=CC=CC=CC2C=CCCC2)CCC11 chemical
O=C(C=CC=CC=CC=CC=CC=CC=CC#CC1=CCCCC1)C=C1CCCCC11 chemical
O=C(CCCCCCCCCCC(=O)NNC(=O)c1ccccc1)NNC(=O)c1ccccc11 chemical
O=C1C=CC(C=CC=CC=CC=CC=CC=CC=CC=CC=CC2=CCCCC2)CC11 chemical
C=C1C=CCCC1C=CC=CC=CC=CC=CC=CC=CC=CC=CC1=CCCCC11 chemical