Guanosine5'-(trihydrogen diphosphate), P'-anhydride with phosphorothioic acid supplier

Name
GTP-GAMMA-S SODIUM SALT
EINECS
CAS No. 37589-80-3
Density 2.68 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₆N₅O₁₃P₃S
Boiling Point 1014.2 °C at 760 mmHg
Molecular Weight 539.25
Flash Point 567.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms GTP-g-S;Guanosine5'-(3-thiotriphosphate);Guanosine 5'-(g-thiotriphosphate);5'-O-(hydroxy{[hydroxy(thiophosphonooxy)phosphoryl]oxy}phosphoryl)guanosine;GSP;GTP [S];GTP-γ-S;
PSA 354.87000
LogP 0.76530

Guanosine5'-(trihydrogen diphosphate), P'-anhydride with phosphorothioic acid Specification

The Guanosine5'-(trihydrogen diphosphate), P'-anhydride with phosphorothioic acid, with the CAS registry number 37589-80-3, has the systematic name of 5'-O-(hydroxy{[hydroxy(thiophosphonooxy)phosphoryl]oxy}phosphoryl)guanosine. And the molecular formula of the chemical is C₁₀H₁₆N₅O₁₃P₃S.

The characteristics of Guanosine5'-(trihydrogen diphosphate), P'-anhydride with phosphorothioic acid are as followings: (1)ACD/LogP: -3.78; (2)# of Rule of 5 Violations: 3; (3)ACD/LogD (pH 5.5): -9.28; (4)ACD/LogD (pH 7.4): -9.79; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 18; (10)#H bond donors: 9; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 241.69 Å²; (13)Index of Refraction: 1.95; (14)Molar Refractivity: 97.13 cm³; (15)Molar Volume: 201 cm³; (16)Polarizability: 38.5×10^-24cm³; (17)Surface Tension: 193.6 dyne/cm; (18)Density: 2.68 g/cm³; (19)Flash Point: 567.1 °C; (20)Enthalpy of Vaporization: 155.12 kJ/mol; (21)Boiling Point: 1014.2 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: S=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n1cnc2c1NC(=N/C2=O)\N)[C@H](O)[C@@H]3O
(2)InChI: InChI=1/C10H16N5O13P3S/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(26-9)1-25-29(19,20)27-30(21,22)28-31(23,24)32/h2-3,5-6,9,16-17H,1H2,(H,19,20)(H,21,22)(H2,23,24,32)(H3,11,13,14,18)/t3-,5-,6-,9-/m1/s1
(3)InChIKey: XOFLBQFBSOEHOG-UUOKFMHZBU

Product Name

GTP-GAMMA-S SODIUM SALT

Guanosine5'-(trihydrogen diphosphate), P'-anhydride with phosphorothioic acid Specification

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