NBTGR - Moligand™ , Inhibitor of Equilibrative nucleoside transporter 1, CAS No.N612181, Inhibitor of Equilibrative nucleoside transporter 1

CAS: N612181 Cat. No.: N612181 PubChem CID: 21117123

GRADE & PURITY Moligand™

Synonyms

nitrobenzylthioguanosine

Storage

Room temperature

Specifications

Synonyme

nitrobenzylthioguanosine

Spezifikationen & Reinheit

Moligand™

Storage

Room temperature

Note

Moligand™

Aktionsart

INHIBITOR

Mechanismus der Wirkung

Inhibitor of Equilibrative nucleoside transporter 1

Namen und Kennungen

• Kanonisches Lächeln: OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(N)n(c2=O)SCc1ccccc1[N+](=O)[O-]
• IUPAC Name: 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-{[(2-nitrophenyl)methyl]sulfanyl}-6,9-dihydro-1H-purin-6-one
• InChIKey: URJSEQDFTMBNCG-XNIJJKJLSA-N
• INCHI: 1S/C17H18N6O7S/c18-17-20-14-11(19-7-21(14)16-13(26)12(25)10(5-24)30-16)15(27)22(17)31-6-8-3-1-2-4-9(8)23(28)29/h1-4,7,10,12-13,16,24-26H,5-6H2,(H2,18,20)/t10-,12-,13-,16-/m1/s1
• Isomere SMILES: C1=CC=C(C(=C1)CSN2C(=O)C3=C(N=C2N)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)[N+](=O)[O-]
• PubChem CID: 21117123

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Nucleosides, nucleotides, and analogues
    • Klasse Purine nucleosides

• Kingdom: Organic compounds
• Superclass: Nucleosides, nucleotides, and analogues
• Klasse: Purine nucleosides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Purine nucleosides
• Alternative Parents: Glycosylamines Hypoxanthines 6-oxopurines Pentoses Nitrobenzenes Nitroaromatic compounds Pyrimidones Aminopyrimidines and derivatives N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Oxolanes Secondary alcohols 1,2-diols Lactams Organic oxoazanium compounds Azacyclic compounds Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Primary alcohols Primary amines
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Purine nucleoside - Glycosyl compound - N-glycosyl compound - Pentose monosaccharide - 6-oxopurine - Purinone - Hypoxanthine - Nitrobenzene - Purine - Imidazopyrimidine - Nitroaromatic compound - Aminopyrimidine - Pyrimidone - Monocyclic benzene moiety - Pyrimidine - N-substituted imidazole - Monosaccharide - Benzenoid - Vinylogous amide - Oxolane - Azole - Heteroaromatic compound - Imidazole - Secondary alcohol - 1,2-diol - Organic nitro compound - C-nitro compound - Lactam - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organic oxoazanium - Organic oxide - Amine - Organic salt - Alcohol - Organic oxygen compound - Organic zwitterion - Hydrocarbon derivative - Primary amine - Primary alcohol - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as purine nucleosides. These are compounds comprising a purine base attached to a ribosyl or deoxyribosyl moiety.
• External Descriptors: Not available

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

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SLC29A1 Tclin Equilibrative nucleoside transporter 1 (1 Activities)

Discover Target: SLC29A1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)