UTPγS

CAT: 0013-GTR19152641Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19152641Size:1 mg

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Description

UTPγS

CAS Number

79049-97-1

Product Name Alternative

Uridine-5'- (γ-thio) -triphosphate, Sodium salt

Purity

≥ 85% (HPLC), contains approx. 10% UDP, which UTPγS decomposes to at room temperature

Form

Solid; Color: white to off-white

Smiles

OP (=S) (O) OP (=O) (OP (=O) (OC[C@@H]1[C@H] ([C@@H] (O) [C@H] (n2ccc (=O) [nH]c2=O) O1) O) O) O

Molecular Formula

C9H15N2O14P3S

Molecular Weight

Theoretical MW: 500.20 g/mol (free acid) ; Detected MW: 499.95 g/mol (free acid)

Storage Conditions

Store at -20 °C

Notes

For research use only.

Applications Notes

Spectroscopic Propertie: λmax 262 nm, ε 10.0 L mmol-1 cm-1 (Tris-HCl, pH 7.5) . Specific Ligands: Ligand for purinergic receptors: Enzymatic stable and potent agonist at P2Y 2/P2Y 4 and P2Y 6 receptors.

Chemical Information

UTPgammaS

CAS Number	79049-97-1
PubChem CID	5311494
IUPAC Name	dihydroxyphosphinothioyl [[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate
Molecular Formula	C9H15N2O14P3S
Molecular Weight	500.21
XLogP	-4.1
Topological Polar Surface Area	274
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	15
Rotatable Bond Count	8
Heavy Atom Count	29
Formal Charge	0
Complexity	844

SMILES

C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=S)(O)O)O)O

InChI

InChI=1S/C9H15N2O14P3S/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(23-8)3-22-26(16,17)24-27(18,19)25-28(20,21)29/h1-2,4,6-8,13-14H,3H2,(H,16,17)(H,18,19)(H,10,12,15)(H2,20,21,29)/t4-,6-,7-,8-/m1/s1

InChIKey

DUDALCZPYHIGIR-XVFCMESISA-N

Chemical Structure

2D Structure

CAS: 79049-97-1

CID: 5311494

Formula: C9H15N2O14P3S

MW: 500.21

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	500.21
XLogP3	-4.1
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	15
Rotatable Bond Count	8
Exact Mass	499.94568532
Monoisotopic Mass	499.94568532
Topological Polar Surface Area	274 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	844
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

UTPγS

Chemical Information

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