Products for Research Use Only
RegisterLogin

Auranofin

CAT: 1568-C10100-03Size: 100 mgDry Ice: YesHazardous: No
Product image 1
1 / 1
CAT#:1568-C10100-03Size:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
34031-32-8
Synonyms
SKF39162
SKU
C10100-1g
Target
Bacterial
Applications
Microbiology
Smiles
CCP (CC) CC.CC (=O) OCC1C (C (C (C (O1) [S-]) OC (=O) C) OC (=O) C) OC (=O) C.[Au+]
Molecular Formula
C20H34AuO9PS
Additionnal Information
Auranofin is an inhibitor of thioredoxin reductase (TrxR) with IC50 of 88 nM for purified H. pylori TrxR in cell-free assay. Auranofin has anti-cancer activity and can completely inhibit bacterial growth at 1.2 μM. Auranofin is an FDA-approved gold-containing compound used for the treatment of rheumatoid arthritis.
Storage Conditions
2 years -80 in solvent

Chemical Information

Auranofin

Auranofin can cause developmental toxicity according to state or federal government labeling requirements.

CAS Number34031-32-8
PubChem CID16667669
IUPAC Namegold(1+);(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxane-2-thiolate;triethylphosphane
Molecular FormulaC20H34AuO9PS
Molecular Weight678.5
Topological Polar Surface Area115
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count12
Heavy Atom Count32
Formal Charge0
Complexity532
SMILES
CCP(CC)CC.CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)[S-])OC(=O)C)OC(=O)C)OC(=O)C.[Au+]
InChI
InChI=1S/C14H20O9S.C6H15P.Au/c1-6(15)19-5-10-11(20-7(2)16)12(21-8(3)17)13(14(24)23-10)22-9(4)18;1-4-7(5-2)6-3;/h10-14,24H,5H2,1-4H3;4-6H2,1-3H3;/q;;+1/p-1/t10-,11-,12+,13-,14+;;/m1../s1
InChIKey
AUJRCFUBUPVWSZ-XTZHGVARSA-M
Chemical Structure
2D Structure
2D structure of Auranofin
CAS: 34031-32-8
CID: 16667669
Formula: C20H34AuO9PS
MW: 678.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight678.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count12
Exact Mass678.132686
Monoisotopic Mass678.132686
Topological Polar Surface Area115 Ų
Heavy Atom Count32
Formal Charge0
Complexity532
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-B1123-01Auranofin

Popular Products