Murcko scaffold
Ring system with 5 rings and 25 atoms
18 chemicals on CompoundList share this ring system.
- Rings
- 5
- Scaffold atoms
- 25
- Chemicals
- 18
- With full pages
- 2
Scaffold SMILES
O=C1CCC2C1CCC1C3CCC(OC4CCCCO4)CC3CCC21
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 18 of 18 chemicals
Androsterone glucuronide
CAS 1852-43-3C25H38O8
Etiocholanolone, 3-glucuronide
CAS 35259-60-0C25H38O9
Etiocholanolone glucuronide
CAS 3602-09-3C25H38O8
Epiandrosterone glucuronide
CAS 4271-00-5C25H38O8
5beta-Androsterone-d5 beta-D-Glucuronide
CAS 1620102-35-3C25H38O8
Glucopyranosiduronic acid, 17-oxo-5alpha-androstan-3alpha-yl, methyl ester, triacetate, beta-D-(8CI)
CAS 21085-73-4C32H46O11
5alpha-Androstan-3alpha,11beta-diol-17-one 3-glucosiduronate
C25H37NaO9
5?-Androsterone ?-D-glucuronide triacetate methyl ester
CAS 21238-41-5C32H46O11
19-Norandrosterone 3-glucuronide
CAS 294213-86-8C24H36O8
19-Noretiocholanolone glucuronide
CAS 294213-87-9C24H36O8
Androsterone-d4 glucuronide
CAS 2687960-87-6C25H38O8
![(2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[[(3S,8S,9S,10S,11S,13S,14S)-11-hydroxy-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]oxane-2-carboxylic acid chemical structure, C25H38O9, CAS 17181-15-6](/s/BRPLOVMHAFXVOQ-KXVRARTKSA-N.svg)
(2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[[(3S,8S,9S,10S,11S,13S,14S)-11-hydroxy-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]oxane-2-carboxylic acid
CAS 17181-15-6C25H38O9
19-Norandrosterone glucuronide-d4
CAS 682355-44-8C24H36O8
(2Alpha,3alpha,5alpha)-2-methyl-17-oxoandrostan-3-yl, beta-D-glucopyranosiduronic acid
CAS 361432-78-2C26H40O8
5|A-Androstan-3|A,11|A-diol-17-one 3-glucosiduronate
C25H37NaO9
5?-Androstan-3?,11?-diol-17-one 3-Glucosiduronate
C25H38O9
![Methyl (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-[[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]oxane-2-carboxylate chemical structure, C32H46O11, CAS 21085-74-5](/s/AMYSMHDMEUWMDZ-UNKAKALLSA-N.svg)
Methyl (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-[[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]oxane-2-carboxylate
CAS 21085-74-5C32H46O11
5a-Androstane-3b-ol-17-one-3-glucuronide Na+ salt
CAS 21085-78-9C25H37NaO8
Related scaffolds
Same ring framework with different atoms or bond orders
c1cc2c(cc1OC1CCCCO1)CCC1C2CCC2CCCC2113 chemicals
C1CCC(OC2CCC3C(CCC4C5CCCC5CCC34)C2)OC111 chemicals
C1=C2CC(OC3CCCCO3)CCC2C2CCC3CCCC3C2C18 chemicals
O=C1CCC2C1CCC1c3ccc(OC4CCCCO4)cc3CCC123 chemicals
O=C1CC2CCCC2C2CCC3CC(OC4CCCCO4)CCC3C121 chemical
C1=C2C3CCCC3CCC2C2CCC(OC3CCCCO3)CC2C11 chemical
O=C1CCC2C1CCC1C3CCC(OC4CCCCO4)CC3=CCC211 chemical
O=C1C=C2C3CCCC3CCC2C2CCC(OC3CCCCO3)CC121 chemical
C1=C2CC(OC3CCCCO3)CCC2C2CCC3CCCC3C2=C11 chemical
O=C1CC2CCCC2C2CC=C3CC(OC4CCCCO4)CCC3C121 chemical