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Chemical structure of NBTGR

GC32500

NBTGR

Also known as (2R,3R,4S,5R)-2-[2-amino-6-[(4-nitrophenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

NBTGR (p-Nitrobenzylthioguanosine) is a potent inhibitor of nucleoside transport; inhibits adenosine uptake with a Ki of 70 nM

ChemicalCAS13153-27-0MW434.43FormulaC17H18N6O6S
CAS number
13153-27-0
Molecular weight
434.43
Formula
C17H18N6O6S
Solubility
DMSO ： 100 mg/mL (230·19 mM; Need ultrasonic)
InChIKey
BRSNNJIJEZWSBU-XNIJJKJLSA-N
Catalogue number
GC32500
Brand
GLPBIO
Computed properties PubChem CID 96048 · XLogP 1.1 · TPSA 211 Ų · H-bond donors 4
XLogP
1.1
TPSA
211 Ų
H-bond donors
4
H-bond acceptors
11
Rotatable bonds
5
Heavy atoms
30

SMILES C1=CC(=CC=C1CSC2=NC(=NC3=C2N=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)N)[N+](=O)[O-]

Computed descriptors from PubChem (CID 96048), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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