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Murcko scaffold

Ring system with 8 rings and 39 atoms

21 chemicals on CompoundList share this ring system.

Rings
8
Scaffold atoms
39
Chemicals
21
With full pages
4
Scaffold SMILES

C1CCC(OC2CCCOC2OC2CCC3C(CCC4C3CCC3C5CC6(CCCCO6)OC5CC34)C2)OC1

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 C1CCC(OC2CCCOC2OC2CCC3C(CCC4C3CCC3C5CC6(CCCCO6)OC5CC34)C2)OC1

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 21 of 21 chemicals

Smilageninoside chemical structure, C39H64O13, CAS 138831-68-2
Smilageninoside
CAS 138831-68-2C39H64O13
Schidigerasaponin D5 chemical structure, C39H64O13, CAS 266998-04-3
Schidigerasaponin D5
CAS 266998-04-3C39H64O13
2beta-Hydroxy-5beta-spirostan-3beta-yl 2-O-beta-D-glucopyranosyl-beta-D-galactopyranoside chemical structure, C39H64O14, CAS 267003-05-4
2beta-Hydroxy-5beta-spirostan-3beta-yl 2-O-beta-D-glucopyranosyl-beta-D-galactopyranoside
CAS 267003-05-4C39H64O14
I(2)-D-Galactopyranoside, (3I(2),5I(2),25S)-spirostan-3-yl 2-O-(2,3,4,6-tetra-O-acetyl-I(2)-D-glucopyranosyl)-, 3,4,6-triacetate chemical structure, C53H78O20, CAS 107800-07-7
I(2)-D-Galactopyranoside, (3I(2),5I(2),25S)-spirostan-3-yl 2-O-(2,3,4,6-tetra-O-acetyl-I(2)-D-glucopyranosyl)-, 3,4,6-triacetate
CAS 107800-07-7C53H78O20
Schidigerasaponin F2 chemical structure, C39H64O14
Schidigerasaponin F2
C39H64O14
Timosaponin A III chemical structure, C39H64O13, CAS 41059-79-4
Timosaponin A III
CAS 41059-79-4C39H64O13
Asparanin A chemical structure, C39H64O13, CAS 84633-33-0
Asparanin A
CAS 84633-33-0C39H64O13
Anemarrhenasaponin A2 chemical structure, C39H64O14, CAS 117210-12-5
Anemarrhenasaponin A2
CAS 117210-12-5C39H64O14
Aspaoligonin A chemical structure, C39H64O14, CAS 852873-37-1
Aspaoligonin A
CAS 852873-37-1C39H64O14
Anemarrhenasaponin III chemical structure, C39H64O14, CAS 163047-23-2
Anemarrhenasaponin III
CAS 163047-23-2C39H64O14
Anemarrhenasaponin III chemical structure, C39H64O14
Anemarrhenasaponin III
C39H64O14
(2alpha,3beta,5alpha,25S)-2,27-Dihydroxyspirostan-3-yl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside chemical structure, C39H64O14, CAS 373647-08-6
(2alpha,3beta,5alpha,25S)-2,27-Dihydroxyspirostan-3-yl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside
CAS 373647-08-6C39H64O14
Torvonin A chemical structure, C39H64O12, CAS 99956-65-7
Torvonin A
CAS 99956-65-7C39H64O12
Timosaponin A IV chemical structure, C39H64O13, CAS 942621-71-8
Timosaponin A IV
CAS 942621-71-8C39H64O13
Anemarrhenasaponin III chemical structure, C39H64O14
Anemarrhenasaponin III
C39H64O14
(2R,3S,4R,5R,6S)-2-[(2S,3S,4R,5R,6S)-4,5-Dihydroxy-6-(hydroxymethyl)-2-[(3S,4R,5'R,6S,7R,9R,13R,16R,18S)-3-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol chemical structure, C39H64O14
(2R,3S,4R,5R,6S)-2-[(2S,3S,4R,5R,6S)-4,5-Dihydroxy-6-(hydroxymethyl)-2-[(3S,4R,5'R,6S,7R,9R,13R,16R,18S)-3-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
C39H64O14
Anemarrhenasaponin a2 chemical structure, C39H64O14
Anemarrhenasaponin a2
C39H64O14
Anemarrhenasaponin III chemical structure, C39H64O14
Anemarrhenasaponin III
C39H64O14
Anemarrhenasaponin a2 chemical structure, C39H64O14
Anemarrhenasaponin a2
C39H64O14
Anemarrhenasaponin III chemical structure, C39H64O14
Anemarrhenasaponin III
C39H64O14
Timosaponin F chemical structure, C39H64O15, CAS 249729-36-0
Timosaponin F
CAS 249729-36-0C39H64O15