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Murcko scaffold

Ring system with 5 rings and 19 atoms

28 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
19
Chemicals
28
With full pages
2
Scaffold SMILES

C1=CC23CCCCC2C2(CCC4CCCC4C12)CO3

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 C1=CC23CCCCC2C2(CCC4CCCC4C12)CO3

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 28 of 28 chemicals

(19R,23E)-5|A,19-Epoxy-19-methoxycucurbita-6,23,25-trien-3|A-ol chemical structure, C31H48O3, CAS 857028-20-7
(19R,23E)-5|A,19-Epoxy-19-methoxycucurbita-6,23,25-trien-3|A-ol
CAS 857028-20-7C31H48O3
Orb1680398 chemical structure, C31H48O3, CAS 874287-87-3
Orb1680398
CAS 874287-87-3C31H48O3
5,19-Epoxy-19,25-dimethoxycucurbita-6,23-dien-3-ol chemical structure, C32H52O4, CAS 85372-72-1
5,19-Epoxy-19,25-dimethoxycucurbita-6,23-dien-3-ol
CAS 85372-72-1C32H52O4
Orb1680429 chemical structure, C31H50O4, CAS 332950-28-4
Orb1680429
CAS 332950-28-4C31H50O4
Karavilagenin E chemical structure, C30H48O3, CAS 877603-72-0
Karavilagenin E
CAS 877603-72-0C30H48O3
19-Methoxy-8-(6-methoxy-6-methylhept-4-en-2-yl)-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-en-16-ol chemical structure, C32H52O4
19-Methoxy-8-(6-methoxy-6-methylhept-4-en-2-yl)-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-en-16-ol
C32H52O4
8-(6-Hydroxy-6-methylhept-4-en-2-yl)-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol chemical structure, C30H48O4
8-(6-Hydroxy-6-methylhept-4-en-2-yl)-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol
C30H48O4
5,9,17,17-Tetramethyl-8-(6-methylhepta-4,6-dien-2-yl)-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol chemical structure, C30H46O3
5,9,17,17-Tetramethyl-8-(6-methylhepta-4,6-dien-2-yl)-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol
C30H46O3
Orb1680410 chemical structure, C32H52O4, CAS 1474062-47-9
Orb1680410
CAS 1474062-47-9C32H52O4
Charantadiol A chemical structure, C30H46O3, CAS 1220890-23-2
Charantadiol A
CAS 1220890-23-2C30H46O3
Momordicoside I aglycone chemical structure, C30H48O3, CAS 81910-41-0
Momordicoside I aglycone
CAS 81910-41-0C30H48O3
5,19-Epoxy-25-methoxycucurbita-6,23-dien-3-ol chemical structure, C31H50O3, CAS 81910-39-6
5,19-Epoxy-25-methoxycucurbita-6,23-dien-3-ol
CAS 81910-39-6C31H50O3
(1R,4S,5S,8R,9R,12S,13S,16S)-8-[(E,2R)-6-Hydroxy-6-methylhept-4-en-2-yl]-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol chemical structure, C30H48O4, CAS 191097-54-8
(1R,4S,5S,8R,9R,12S,13S,16S)-8-[(E,2R)-6-Hydroxy-6-methylhept-4-en-2-yl]-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol
CAS 191097-54-8C30H48O4
5,19-Epoxy-19R,25-dimethoxycucurbita-6,23-dien-3-ol chemical structure, C32H52O4
5,19-Epoxy-19R,25-dimethoxycucurbita-6,23-dien-3-ol
C32H52O4
(1R,4S,5S,8R,9R,12S,13S,16S)-5,9,17,17-Tetramethyl-8-[(2R,4E)-6-methylhepta-4,6-dien-2-yl]-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol chemical structure, C30H46O3
(1R,4S,5S,8R,9R,12S,13S,16S)-5,9,17,17-Tetramethyl-8-[(2R,4E)-6-methylhepta-4,6-dien-2-yl]-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol
C30H46O3
Kuguacin R chemical structure, C30H48O4
Kuguacin R
C30H48O4
5,19-Epoxy-19S,25-dimethoxycucurbita-6,23-dien-3-ol chemical structure, C32H52O4, CAS 85372-70-9
5,19-Epoxy-19S,25-dimethoxycucurbita-6,23-dien-3-ol
CAS 85372-70-9C32H52O4
(1R,4S,5S,8R,9R,13S,16S,19S)-8-[(E,2R)-6-Hydroxy-6-methylhept-4-en-2-yl]-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol chemical structure, C30H48O4
(1R,4S,5S,8R,9R,13S,16S,19S)-8-[(E,2R)-6-Hydroxy-6-methylhept-4-en-2-yl]-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol
C30H48O4
(19R,23E)-5b,19-Epoxy19-ethoxycucurbita-6,23-diene-3b,25-diol chemical structure, C32H52O4, CAS 1301267-02-6
(19R,23E)-5b,19-Epoxy19-ethoxycucurbita-6,23-diene-3b,25-diol
CAS 1301267-02-6C32H52O4
(23E)-5b,19-Epoxycucurbita-6,23,25(26)-triene-3b-ol chemical structure, C30H46O2, CAS 1301267-01-5
(23E)-5b,19-Epoxycucurbita-6,23,25(26)-triene-3b-ol
CAS 1301267-01-5C30H46O2
(1S,4R,5R,8S,9S,13R,16R,19R)-8-[(E,2S)-6-Hydroxy-6-methylhept-4-en-2-yl]-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol chemical structure, C30H48O4
(1S,4R,5R,8S,9S,13R,16R,19R)-8-[(E,2S)-6-Hydroxy-6-methylhept-4-en-2-yl]-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol
C30H48O4
19-Methoxy-8-[(E)-6-methoxy-6-methylhept-4-en-2-yl]-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-en-16-ol chemical structure, C32H52O4
19-Methoxy-8-[(E)-6-methoxy-6-methylhept-4-en-2-yl]-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-en-16-ol
C32H52O4
5,9,17,17-Tetramethyl-8-[(4E)-6-methylhepta-4,6-dien-2-yl]-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol chemical structure, C30H46O3
5,9,17,17-Tetramethyl-8-[(4E)-6-methylhepta-4,6-dien-2-yl]-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol
C30H46O3
8-[(E)-6-Hydroxy-6-methylhept-4-en-2-yl]-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol chemical structure, C30H48O4
8-[(E)-6-Hydroxy-6-methylhept-4-en-2-yl]-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-ene-16,19-diol
C30H48O4