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8-Aminoinosine

CAT: 0013-GTR19208456-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19208456-01Size:25 mg
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Description
8-Aminoinosine is an endogenous 8-aminopurine that acts as a potent inhibitor of purine nucleoside phosphorylase (PNPase) . Its inhibition of PNPase induces diuretic, natriuretic, and glucosuric effects, making it a valuable research tool for studying purine metabolism, renal function, and related metabolic disorders in both in vitro and in vivo models.
CAS Number
13389-16-7
Smiles
NC=1N (C2=C (N1) C (=O) N=CN2) [C@@H]3O[C@H] (CO) [C@@H] (O) [C@H]3O
Molecular Formula
C10H13N5O5
Molecular Weight
283.24
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

8-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one
CAS Number13389-16-7
PubChem CID135494061
IUPAC Name8-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-6-one
Molecular FormulaC10H13N5O5
Molecular Weight283.24
XLogP-2.5
Topological Polar Surface Area155
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count8
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity434
SMILES
C1=NC2=C(C(=O)N1)N=C(N2C3C(C(C(O3)CO)O)O)N
InChI
InChI=1S/C10H13N5O5/c11-10-14-4-7(12-2-13-8(4)19)15(10)9-6(18)5(17)3(1-16)20-9/h2-3,5-6,9,16-18H,1H2,(H2,11,14)(H,12,13,19)
InChIKey
OBCXRIVPFSZZSN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 8-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one
CAS: 13389-16-7
CID: 135494061
Formula: C10H13N5O5
MW: 283.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight283.24
XLogP3-2.5
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count8
Rotatable Bond Count2
Exact Mass283.09166853
Monoisotopic Mass283.09166853
Topological Polar Surface Area155 Ų
Heavy Atom Count20
Formal Charge0
Complexity434
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count4
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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