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SB 204990 - ≥98%(HPLC), high purity , CAS No.154566-12-8

1 Citations COA COA
    Grade & Purity:
  • ≥98%(HPLC)
In stock
Item Number
S286623
Grouped product items
SKU Size
Availability
 Price Qty
S286623-5mg
5mg
2
$112.90
S286623-10mg
10mg
1
$197.90
S286623-25mg
25mg
Available within 4-8 weeks(?)
Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!
$445.90
S286623-50mg
50mg
2
$706.90
S286623-100mg
100mg
2
$1,226.90
Wish List
Bulk Order  SDS  DATASHEET  Specification Sheet

ATP citrate lyase (ACLY) inhibitor

View related series
ATP Citrate Lyase (14) Lipid metabolism (1912) Metabolic Enzyme/Protease (4860)

Basic Description

Synonyms (3R,5S)-rel-5-[6-(2,4-Dichlorophenyl)hexyl]tetrahydro-3-hydroxy-2-oxo-3-furanacetic acid | SB-204990 | 2-[(3S,5R)-5-[6-(2,4-dichlorophenyl)hexyl]-3-hydroxy-2-oxooxolan-3-yl]acetic acid | EX-A6876 | 3-Furanacetic acid, 5-(6-(2,4-dichlorophenyl)hexyl)tetrah
Specifications & Purity ≥98%(HPLC)
Biochemical and Physiological Mechanisms SB-204990 is a cell-permeable and orally available γ-lactone prodrug of the non-cell-permeable SB-201076 that inhibits human and rat ATP citrate-lyase (Ki =1 μM against human and rat ACL) in a predominantly competitive manner with a small but significant
Storage Temp Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Benzenoids
Class Benzene and substituted derivatives
Subclass Halobenzenes
Intermediate Tree Nodes Chlorobenzenes
Direct Parent Dichlorobenzenes
Alternative Parents Gamma butyrolactones  Dicarboxylic acids and derivatives  Aryl chlorides  Tertiary alcohols  Oxolanes  Carboxylic acid esters  Oxacyclic compounds  Carboxylic acids  Organochlorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular Framework Aromatic heteromonocyclic compounds
Substituents 1,3-dichlorobenzene - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Gamma butyrolactone - Tertiary alcohol - Oxolane - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Organohalogen compound - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic oxide - Organic oxygen compound - Organochloride - Organooxygen compound - Aromatic heteromonocyclic compound
Description This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
External Descriptors Not available

Associated Targets(Human)

ACLY Tclin ATP-citrate synthase (168 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
PC-3 (62116 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
SK-OV-3 (52876 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
A549 (127892 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

Rattus norvegicus (775804 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

IUPAC Name 2-[(3S,5R)-5-[6-(2,4-dichlorophenyl)hexyl]-3-hydroxy-2-oxooxolan-3-yl]acetic acid
INCHI InChI=1S/C18H22Cl2O5/c19-13-8-7-12(15(20)9-13)5-3-1-2-4-6-14-10-18(24,11-16(21)22)17(23)25-14/h7-9,14,24H,1-6,10-11H2,(H,21,22)/t14-,18+/m1/s1
InChIKey YTRNLFYTHYWDAU-KDOFPFPSSA-N
Smiles C1C(OC(=O)C1(CC(=O)O)O)CCCCCCC2=C(C=C(C=C2)Cl)Cl
Isomeric SMILES C1[C@H](OC(=O)[C@]1(CC(=O)O)O)CCCCCCC2=C(C=C(C=C2)Cl)Cl
PubChem CID 10340264
Molecular Weight 389.27

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

5 results found

Lot Number Certificate Type Date Item
K2219122 Certificate of Analysis Sep 07, 2022 S286623
K2219131 Certificate of Analysis Sep 07, 2022 S286623
K2219132 Certificate of Analysis Sep 07, 2022 S286623
K2219133 Certificate of Analysis Sep 07, 2022 S286623
K2219130 Certificate of Analysis Sep 07, 2022 S286623

Chemical and Physical Properties

Solubility Solvent:DMSO, Max Conc. mg/mL: 38.93, Max Conc. mM: 100; Solvent:ethanol, Max Conc. mg/mL: 38.93, Max Conc. mM: 100
Molecular Weight 389.300 g/mol
XLogP3 5.100
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 9
Exact Mass 388.084 Da
Monoisotopic Mass 388.084 Da
Topological Polar Surface Area 83.800 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 472.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 1

Solution Calculators

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