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Murcko scaffold

Ring system with 6 rings and 38 atoms

88 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
38
Chemicals
88
With full pages
19
Scaffold SMILES

O=C(CCc1ccccc1)OC1C=C2CC(=O)C3CCC4OCC4C3C(OC(=O)c3ccccc3)C(C2)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=C(CCc1ccccc1)OC1C=C2CC(=O)C3CCC4OCC4C3C(OC(=O)c3ccccc3)C(C2)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 48 of 88 chemicals

Docetaxol chemical structure, C43H53NO14, CAS 114915-20-7
Docetaxol
CAS 114915-20-7C43H53NO14
Docetaxal chemical structure, C45H55NO15, CAS 125354-16-7
Docetaxal
CAS 125354-16-7C45H55NO15
Docetaxel trihydrate chemical structure, C43H59NO17, CAS 148408-66-6
Docetaxel trihydrate
CAS 148408-66-6C43H59NO17
Docetaxel chemical structure, C43H53NO14, CAS 114977-28-5
Docetaxel
CAS 114977-28-5C43H53NO14
Baccatin III 13-(R-3-phenyllactate) chemical structure, C40H46O13, CAS 131760-45-7
Baccatin III 13-(R-3-phenyllactate)
CAS 131760-45-7C40H46O13
Taxoline chemical structure, C45H55NO14, CAS 213539-42-5
Taxoline
CAS 213539-42-5C45H55NO14
Taxcultine chemical structure, C44H53NO14, CAS 153415-46-4
Taxcultine
CAS 153415-46-4C44H53NO14
Cephalomannine chemical structure, C45H53NO14, CAS 71610-00-9
Cephalomannine
CAS 71610-00-9C45H53NO14
10-Deacetylcephalomannine chemical structure, C43H51NO13, CAS 76429-85-1
10-Deacetylcephalomannine
CAS 76429-85-1C43H51NO13
N-Debenzoyltaxol chemical structure, C40H47NO13, CAS 133524-70-6
N-Debenzoyltaxol
CAS 133524-70-6C40H47NO13
Cabazitaxel chemical structure, C45H57NO14, CAS 183133-96-2
Cabazitaxel
CAS 183133-96-2C45H57NO14
10-Deacetyltaxol C chemical structure, C44H55NO13, CAS 154677-95-9
10-Deacetyltaxol C
CAS 154677-95-9C44H55NO13
Qtcvmfmwhtvjtq-lnjgeebysa- chemical structure, C49H55Cl6NO18
Qtcvmfmwhtvjtq-lnjgeebysa-
C49H55Cl6NO18
Taxol C chemical structure, C46H57NO14, CAS 153415-45-3
Taxol C
CAS 153415-45-3C46H57NO14
N-Methyltaxol C chemical structure, C47H59NO14, CAS 153083-53-5
N-Methyltaxol C
CAS 153083-53-5C47H59NO14
Orb3178055 chemical structure, C46H57NO14, CAS 156130-25-5
Orb3178055
CAS 156130-25-5C46H57NO14
Taxuspinanane A chemical structure, C47H59NO14, CAS 187740-00-7
Taxuspinanane A
CAS 187740-00-7C47H59NO14
N-Debenzoyl-7-{[(2,2,2,-trichloroethyl)oxy]carbonyl} Paclitaxel chemical structure, C43H48Cl3NO15, CAS 114915-15-0
N-Debenzoyl-7-{[(2,2,2,-trichloroethyl)oxy]carbonyl} Paclitaxel
CAS 114915-15-0C43H48Cl3NO15
N-Des-t-boc-10-deacetyl-7,10-O-bis{[(2,2,2-trichloroethyl)oxy]carbonyl} Docetaxel chemical structure, C44H47Cl6NO16, CAS 114915-16-1
N-Des-t-boc-10-deacetyl-7,10-O-bis{[(2,2,2-trichloroethyl)oxy]carbonyl} Docetaxel
CAS 114915-16-1C44H47Cl6NO16
N-Debenzoyl-N-[(3E)-hex-3-enoyl] Paclitaxel chemical structure, C46H55NO14, CAS 502626-06-4
N-Debenzoyl-N-[(3E)-hex-3-enoyl] Paclitaxel
CAS 502626-06-4C46H55NO14
10-Deacetyl-3'-debenzoylpaclitaxel chemical structure, C38H45NO12, CAS 133524-69-3
10-Deacetyl-3'-debenzoylpaclitaxel
CAS 133524-69-3C38H45NO12
Docetaxel 2'-tert-Butyldimethylsilyl 7,10-Tris(triethylsilyl) Ether chemical structure, C61H95NO14Si3, CAS 195141-96-9
Docetaxel 2'-tert-Butyldimethylsilyl 7,10-Tris(triethylsilyl) Ether
CAS 195141-96-9C61H95NO14Si3
Docetaxel intermediate chemical structure, C43H53NO14, CAS 1217445-55-0
Docetaxel intermediate
CAS 1217445-55-0C43H53NO14
N-Debenzoylpaclitaxel 1-oxopentyl amino ester chemical structure, C45H55NO14, CAS 173101-55-8
N-Debenzoylpaclitaxel 1-oxopentyl amino ester
CAS 173101-55-8C45H55NO14