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Aliskiren Hemifumarate - ≥98%, high purity , Renin inhibitor, CAS No.173334-58-2, Renin inhibitor

COA COA
    Grade & Purity:
  • ≥98%
In stock
Item Number
A129231
Grouped product items
SKU Size
Availability
 Price Qty
A129231-10mg
10mg
3
$64.90
A129231-50mg
50mg
3
$142.90
A129231-100mg
100mg
3
$234.90
A129231-250mg
250mg
2
$528.90
A129231-500mg
500mg
2
$951.90
A129231-1g
1g
4
$1,713.90
A129231-5g
5g
2
$7,709.90
Wish List
Bulk Order  SDS  DATASHEET  Specification Sheet

Potent renin inhibitor; antihypertensive

View related series
Amino Acid/Protein Metabolism (1836) Autophagy (1917) Metabolic Enzyme/Protease (4860) Renin (15)

Basic Description

Synonyms CHEBI:141362 | SCHEMBL187762 | ALISKIREN HEMIFUMARATE [MI] | AMTURNIDE COMPONENT ALISKIREN HEMIFUMARATE | Aliskiren fumarate (JAN/USAN) | NSC-759185 | RASITRIO COMPONENT ALISKIREN HEMIFUMARATE | CCG-270658 | STL557239 | AKOS015896419 | UNII-C8A0P8G029 | (
Specifications & Purity ≥98%
Biochemical and Physiological Mechanisms Potent renin inhibitor (IC50= 0.6 and 80 nM for human and rat respectively). Exhibits selectivity for renin over a range of other aspartic proteinases (>5000 nM). Lowers blood pressure in a hypertensive rodent model. Orally active.
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.
Action Type INHIBITOR
Mechanism of action Renin inhibitor
Product Description

Aliskiren hemifumarate is a direct renin inhibitor with IC50 of 1.5 nM.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organic acids and derivatives
Class Carboxylic acids and derivatives
Subclass Amino acids, peptides, and analogues
Intermediate Tree Nodes Amino acids and derivatives
Direct Parent Delta amino acids and derivatives
Alternative Parents Beta amino acids and derivatives  Phenylbutylamines  Anisoles  Methoxybenzenes  Phenoxy compounds  Alkyl aryl ethers  Aralkylamines  N-acyl amines  Dicarboxylic acids and derivatives  Unsaturated fatty acids  1,2-aminoalcohols  Secondary carboxylic acid amides  Primary carboxylic acid amides  Secondary alcohols  Dialkyl ethers  Carboxylic acids  Organopnictogen compounds  Organic oxides  Monoalkylamines  Hydrocarbon derivatives  Carbonyl compounds  
Molecular Framework Not available
Substituents Delta amino acid or derivatives - Phenylbutylamine - Beta amino acid or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Aralkylamine - Fatty acid - Benzenoid - Unsaturated fatty acid - Dicarboxylic acid or derivatives - Fatty amide - N-acyl-amine - Fatty acyl - Monocyclic benzene moiety - 1,2-aminoalcohol - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Primary carboxylic acid amide - Ether - Dialkyl ether - Carboxylic acid - Amine - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic oxide - Organopnictogen compound - Primary aliphatic amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Aromatic homomonocyclic compound
Description This compound belongs to the class of organic compounds known as delta amino acids and derivatives. These are compounds containing a carboxylic acid group and an amino group at the C5 carbon atom.
External Descriptors fumarate salt

Associated Targets(Human)

REN Tclin Renin (2 Activities)
Activity Type Activity Value -log(M) Mechanism of Action Activity Reference Publications (PubMed IDs)
KCNH2 Tclin HERG (29587 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
REN Tclin Renin (5251 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
ABCC2 Tchem Canalicular multispecific organic anion transporter 1 (1191 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
ABCB11 Tchem Bile salt export pump (2311 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
ABCC3 Tbio Canalicular multispecific organic anion transporter 2 (718 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
ABCC4 Tchem Multidrug resistance-associated protein 4 (785 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

Canis familiaris (36305 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Cynomolgus monkey (4946 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
rep Replicase polyprotein 1ab (378 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

Pubchem Sid 488195878
Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488195878
IUPAC Name (2S,4S,5S,7S)-5-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-7-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-8-methyl-2-propan-2-ylnonanamide;(E)-but-2-enedioic acid
INCHI InChI=1S/2C30H53N3O6.C4H4O4/c2*1-19(2)22(14-21-10-11-26(38-8)27(15-21)39-13-9-12-37-7)16-24(31)25(34)17-23(20(3)4)28(35)33-18-30(5,6)29(32)36;5-3(6)1-2-4(7)8/h2*10-11,15,19-20,22-25,34H,9,12-14,16-18,31H2,1-8H3,(H2,32,36)(H,33,35);1-2H,(H,5,6)(H,7,8)/b;;2-1+/t2*22-,23-,24-,25-;/m00./s1
InChIKey KLRSDBSKUSSCGU-KRQUFFFQSA-N
Smiles CC(C)C(CC1=CC(=C(C=C1)OC)OCCCOC)CC(C(CC(C(C)C)C(=O)NCC(C)(C)C(=O)N)O)N.CC(C)C(CC1=CC(=C(C=C1)OC)OCCCOC)CC(C(CC(C(C)C)C(=O)NCC(C)(C)C(=O)N)O)N.C(=CC(=O)O)C(=O)O
Isomeric SMILES CC(C)[C@@H](CC1=CC(=C(C=C1)OC)OCCCOC)C[C@@H]([C@H](C[C@@H](C(C)C)C(=O)NCC(C)(C)C(=O)N)O)N.CC(C)[C@@H](CC1=CC(=C(C=C1)OC)OCCCOC)C[C@@H]([C@H](C[C@@H](C(C)C)C(=O)NCC(C)(C)C(=O)N)O)N.C(=C/C(=O)O)\C(=O)O
PubChem CID 6918427
Molecular Weight 609.83

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.

7 results found

Lot Number Certificate Type Date Item
G2208063 Certificate of Analysis Apr 07, 2024 A129231
G2208064 Certificate of Analysis Apr 07, 2024 A129231
G2208062 Certificate of Analysis Apr 07, 2024 A129231
G2208065 Certificate of Analysis Apr 07, 2024 A129231
C23031331 Certificate of Analysis Mar 31, 2023 A129231
A1516024 Certificate of Analysis Dec 09, 2022 A129231
G2208061 Certificate of Analysis Mar 10, 2022 A129231

Chemical and Physical Properties

Solubility Solvent:water, Max Conc. mg/mL: 60.98, Max Conc. mM: 100; Solvent:DMSO, Max Conc. mg/mL: 60.98, Max Conc. mM: 100
Sensitivity Heat, light sensitive
Molecular Weight 1219.600 g/mol
XLogP3
Hydrogen Bond Donor Count 10
Hydrogen Bond Acceptor Count 18
Rotatable Bond Count 40
Exact Mass 1218.8 Da
Monoisotopic Mass 1218.8 Da
Topological Polar Surface Area 367.000 Ų
Heavy Atom Count 86
Formal Charge 0
Complexity 836.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 8
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 1
Covalently-Bonded Unit Count 3

Solution Calculators

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