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Murcko scaffold

Ring system with 4 rings and 24 atoms

65 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
24
Chemicals
65
With full pages
23
Scaffold SMILES

O=c1c(-c2ccccc2)coc2cc(OC3CCCCO3)ccc12

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=c1c(-c2ccccc2)coc2cc(OC3CCCCO3)ccc12

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 65 chemicals

Daidzin chemical structure, C21H20O9, CAS 552-66-9
Daidzin
CAS 552-66-9C21H20O9
6''-O-Acetyldaidzin chemical structure, C23H22O10, CAS 71385-83-6
6''-O-Acetyldaidzin
CAS 71385-83-6C23H22O10
Glycitin chemical structure, C22H22O10, CAS 40246-10-4
Glycitin
CAS 40246-10-4C22H22O10
3-(4-Hydroxyphenyl)-5-methoxy-4-oxo-4H-1-benzopyran-7-yl hexopyranoside chemical structure, C22H22O10, CAS 128856-77-9
3-(4-Hydroxyphenyl)-5-methoxy-4-oxo-4H-1-benzopyran-7-yl hexopyranoside
CAS 128856-77-9C22H22O10
Ononin chemical structure, C22H22O9, CAS 486-62-4
Ononin
CAS 486-62-4C22H22O9
3-(4-Chlorophenyl)-7-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one chemical structure, C21H19ClO8, CAS 1093230-81-9
3-(4-Chlorophenyl)-7-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one
CAS 1093230-81-9C21H19ClO8
Npc198030 chemical structure, C22H22O9, CAS 1084808-15-0
Npc198030
CAS 1084808-15-0C22H22O9
Sissotrin chemical structure, C22H22O10, CAS 5928-26-7
Sissotrin
CAS 5928-26-7C22H22O10
Genistin chemical structure, C21H20O10, CAS 529-59-9
Genistin
CAS 529-59-9C21H20O10
Iridin chemical structure, C24H26O13, CAS 491-74-7
Iridin
CAS 491-74-7C24H26O13
Tectoridin chemical structure, C22H22O11, CAS 611-40-5
Tectoridin
CAS 611-40-5C22H22O11
Biochanin A 7-O-beta-D-glucoside 6''-O-malonate chemical structure, C25H24O13, CAS 34232-17-2
Biochanin A 7-O-beta-D-glucoside 6''-O-malonate
CAS 34232-17-2C25H24O13
6''-O-Acetylgenistin chemical structure, C23H22O11, CAS 73566-30-0
6''-O-Acetylgenistin
CAS 73566-30-0C23H22O11
Calycosin 7-o-beta-D-glucoside chemical structure, C22H22O10, CAS 20633-67-4
Calycosin 7-o-beta-D-glucoside
CAS 20633-67-4C22H22O10
Iristectorin B chemical structure, C23H24O12, CAS 94396-09-5
Iristectorin B
CAS 94396-09-5C23H24O12
4H-1-Benzopyran-4-one, 3-(3,4-dihydroxyphenyl)-7-(beta-D-glucopyranosyloxy)-5-hydroxy- chemical structure, C21H20O11, CAS 20486-33-3
4H-1-Benzopyran-4-one, 3-(3,4-dihydroxyphenyl)-7-(beta-D-glucopyranosyloxy)-5-hydroxy-
CAS 20486-33-3C21H20O11
6''-O-Malonyldaidzin chemical structure, C24H22O12, CAS 124590-31-4
6''-O-Malonyldaidzin
CAS 124590-31-4C24H22O12
Kakkalidone chemical structure, C23H24O11, CAS 6009-88-7
Kakkalidone
CAS 6009-88-7C23H24O11
Wistin chemical structure, C23H24O10, CAS 19046-26-5
Wistin
CAS 19046-26-5C23H24O10
6''-O-Acetylglycitin chemical structure, C24H24O11, CAS 134859-96-4
6''-O-Acetylglycitin
CAS 134859-96-4C24H24O11
2'-Hydroxygenistein-7-O-glucoside chemical structure, C21H20O11, CAS 137351-12-3
2'-Hydroxygenistein-7-O-glucoside
CAS 137351-12-3C21H20O11
Odoratin-7-O-beta-D-glucopyranoside chemical structure, C23H24O11, CAS 210413-47-1
Odoratin-7-O-beta-D-glucopyranoside
CAS 210413-47-1C23H24O11
3'-Methoxydaidzin chemical structure, C22H22O10, CAS 200127-80-6
3'-Methoxydaidzin
CAS 200127-80-6C22H22O10
Daidzein 7-O-glucuronide chemical structure, C21H18O10, CAS 38482-80-3
Daidzein 7-O-glucuronide
CAS 38482-80-3C21H18O10