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Β-Anomer

CAT: 1410-M37890-03Size: 50 mgDry Ice: NoHazardous: No
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CAT#:1410-M37890-03Size:50 mg
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Description
Β-Anomer shows antiviral properties.
CAS Number
356782-84-8
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
271.23
Molecular Formula
C10H13N3O6
Notes
Research use only, not for human use.
Receptor
Antiviral

Chemical Information

T-1106

an antiviral agent; structure in first source

CAS Number356782-84-8
PubChem CID5271819
IUPAC Name4-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-oxopyrazine-2-carboxamide
Molecular FormulaC10H13N3O6
Molecular Weight271.23
XLogP-2.2
Topological Polar Surface Area146
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Heavy Atom Count19
Formal Charge0
Complexity462
SMILES
C1=CN(C(=O)C(=N1)C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
InChI
InChI=1S/C10H13N3O6/c11-8(17)5-9(18)13(2-1-12-5)10-7(16)6(15)4(3-14)19-10/h1-2,4,6-7,10,14-16H,3H2,(H2,11,17)/t4-,6-,7-,10-/m1/s1
InChIKey
XVXWUBIIHFDOJO-KQYNXXCUSA-N
Chemical Structure
2D Structure
2D structure of T-1106
CAS: 356782-84-8
CID: 5271819
Formula: C10H13N3O6
MW: 271.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight271.23
XLogP3-2.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Exact Mass271.08043514
Monoisotopic Mass271.08043514
Topological Polar Surface Area146 Ų
Heavy Atom Count19
Formal Charge0
Complexity462
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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