Abacavir sulfate - ≥99% , Human immunodeficiency virus type 1 reverse transcriptase inhibitor, CAS No.188062-50-2, Human immunodeficiency virus type 1 reverse transcriptase inhibitor

CAS: 188062-50-2 Cat. No.: A129792 Fórmula: C₁₄H₁₈N₆O·1/2 H₂O₄S Peso molecular: 335.35 Número CE: 620-488-4 PubChem CID: 441384

GRADE & PURITY ≥99%

Synonyms

Sulfato de abacavir | Sulfato de abacavir (JAN/USP) | B6091 | Sulfato de abacavir racémico [USP-RS] | NSC-760063 | SULFATO DE ABACAVIR (MART.) | AS-17843 | DRG-0257 | Sulfato de abacavir (USAN:USP) | SULFATO DE ABACAVIR [JAN] | SULFATO DE ABACAVIR [USP MO

Storage

Armazenar a 2-8°C

Shipped In

Gelo húmido

Visão geral

O abacavir é um análogo nucleósido comummente utilizado com uma potente atividade antivírica contra o VIH-1.
Um inibidor nucleósido da transcriptase reversa.

Specifications

Sinónimos

Sulfato de abacavir | Sulfato de abacavir (JAN/USP) | B6091 | Sulfato de abacavir racémico [USP-RS] | NSC-760063 | SULFATO DE ABACAVIR (MART.) | AS-17843 | DRG-0257 | Sulfato de abacavir (USAN:USP) | SULFATO DE ABACAVIR [JAN] | SULFATO DE ABACAVIR [USP MO

Especificações e pureza

≥99%

Mecanismos bioquímicos e fisiológicos

O sulfato de abacavir é um inibidor da transcriptase reversa análogo de nucleósido (NRTI); análogo da guanosina utilizado para tratar o VIH e a SIDA; o sulfato de abacavir é a forma de sulfato do abacavir, um inibidor da transcriptase reversa nucleósido (

Condições de armazenamento de armazenamento

Armazenar a 2-8°C

Enviado em

Gelo húmido

Tipo de ação

INHIBITOR

Mecanismo de ação

Human immunodeficiency virus type 1 reverse transcriptase inhibitor

Nota

Sempre que possível, deve preparar e utilizar as soluções no mesmo dia. No entanto, se precisar de preparar soluções de reserva com antecedência, recomendamos que guarde a solução como alíquotas em frascos hermeticamente fechados a -20°C. Em geral, estas podem ser utilizadas durante um mês. Antes de utilizar, e antes de abrir o frasco para injectáveis, recomendamos que deixe o seu produto equilibrar à temperatura ambiente durante pelo menos 1 hora. Precisa de mais conselhos sobre solubilidade, utilização e manuseamento? Para mais informações, visite a nossa página de perguntas frequentes (FAQ).

Pureza

≥99%

Nomes e identificadores

• Pubchem Sid: 488189783
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488189783
• Sorrisos canónicos: C1CC1NC2=C3C(=NC(=N2)N)N(C=N3)C4CC(C=C4)CO.C1CC1NC2=C3C(=NC(=N2)N)N(C=N3)C4CC(C=C4)CO.OS(=O)(=O)O
• IUPAC Name: [(1S,4R)-4-[2-amino-6-(cyclopropylamino)purin-9-yl]cyclopent-2-en-1-yl]methanol;sulfuric acid
• InChIKey: WMHSRBZIJNQHKT-FFKFEZPRSA-N
• INCHI: 1S/2C14H18N6O.H2O4S/c2*15-14-18-12(17-9-2-3-9)11-13(19-14)20(7-16-11)10-4-1-8(5-10)6-21;1-5(2,3)4/h2*1,4,7-10,21H,2-3,5-6H2,(H3,15,17,18,19);(H2,1,2,3,4)/t2*8-,10+;/m11./s1
• SMILES isoméricas: C1CC1NC2=C3C(=NC(=N2)N)N(C=N3)[C@@H]4C[C@@H](C=C4)CO.C1CC1NC2=C3C(=NC(=N2)N)N(C=N3)[C@@H]4C[C@@H](C=C4)CO.OS(=O)(=O)O
• WGK Alemanha: 3
• PubChem CID: 441384
• Peso molecular: 335.35

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Nucleosides, nucleotides, and analogues
    • Classe Nucleoside and nucleotide analogues
      • Subclass Cyclopentyl nucleosides
        • Level5 1,3-substituted cyclopentyl nucleosides
          • Level6 1,3-substituted cyclopentyl purine nucleosides

• Kingdom: Organic compounds
• Superclass: Nucleosides, nucleotides, and analogues
• Classe: Nucleoside and nucleotide analogues
• Subclass: Cyclopentyl nucleosides
• Intermediate Tree Nodes: 1,3-substituted cyclopentyl nucleosides
• Direct Parent: 1,3-substituted cyclopentyl purine nucleosides
• Alternative Parents: 6-alkylaminopurines Secondary alkylarylamines Aminopyrimidines and derivatives Organic sulfuric acids N-substituted imidazoles Imidolactams Heteroaromatic compounds Azacyclic compounds Primary amines Primary alcohols Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Not available
• Substituents: 1,3-substituted cyclopentyl purine nucleoside - 6-alkylaminopurine - 6-aminopurine - Imidazopyrimidine - Purine - Aminopyrimidine - Sulfuric acid - Secondary aliphatic/aromatic amine - Imidolactam - N-substituted imidazole - Pyrimidine - Heteroaromatic compound - Azole - Imidazole - Organic sulfuric acid or derivatives - Azacycle - Organoheterocyclic compound - Secondary amine - Organonitrogen compound - Alcohol - Amine - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Primary alcohol - Primary amine - Aromatic heteropolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as 1,3-substituted cyclopentyl purine nucleosides. These are nucleoside analogues with a structure that consists of a cyclobutane that is substituted a the 1-position with a hydroxyl group and at the 3-position with either a purine base.
• External Descriptors: azaheterocycle sulfate salt

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Alvos associados (não humanos)

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Human immunodeficiency virus 1 (70413 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Soluble in water (77 mg/ml), DMSO (< 1 mg/ml at 25 °C), ethanol (< 1 mg/ml at 25 °C), and methanol
• Peso molecular: 670.700 g/mol
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 8
• Exact Mass: 670.276 Da
• Monoisotopic Mass: 670.276 Da
• Topological Polar Surface Area: 287.000 Ų
• Heavy Atom Count: 47
• Formal Charge: 0
• Complexity: 496.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• 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: 3

XLogP3

Referências

1. Nanshan Song, Xiangxu Wang, Luqing Ha, Lamei Hu, Shuyuan Mei, Yue Liang, Yujie Zhao, Xingyin Yang, Qingyu Zhang, Yuanzhang Zhou, Jianhua Ding, Yan Liu, Qigang Zhou, Feng Han, Gang Hu, Ming Lu.  (2025)  Neuronal FGF13 Inhibits Mitochondria-Derived Damage Signals to Prevent Neuroinflammation and Neurodegeneration in a Mouse Model of Parkinson's Disease.  Advanced Science,      [PMID:40344619] [10.1002/advs.202503579]