5-Guanylic Acid Sodium Salt - CAS 13474-02-7

Catalog:	BB064441
Product Name:	5-Guanylic Acid Sodium Salt
CAS:	13474-02-7
Synonyms:	5'-GMP Sodium Salt; E 626 Sodium Salt; GMP Sodium Salt; Guanidine Monophosphate Sodium Salt; Guanosine 5'-(Dihydrogen Phosphate) Sodium Salt; Guanosine 5'-Monophosphate Sodium Salt; Guanosine 5'-Phosphate Sodium Salt; Guanosine 5'-Phosphoric Acid Sodium Salt; Guanosine Monophosphate Sodium Salt; Guanylic Acid Sodium Salt

Technical Data

IUPAC Name:	disodium[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate
Description:	5-Guanylic Acid Sodium Salt is a nucleoside that causes relaxation of the bovine coronary arterial smooth muscle.
Molecular Weight:	363.22 + x(22.99)
Molecular Formula:	C10H14N5O8P·x(Na)
Canonical SMILES:	C1=NC2=C(N1C3C(C(C(O3)COP(=O)([O-])[O-])O)O)N=C(NC2=O)N.[Na+].[Na+]
InChI:	InChI=1S/C10H14N5O8P.2Na/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(23-9)1-22-24(19,20)21/h2-3,5-6,9,16-17H,1H2,(H2,19,20,21)(H3,11,13,14,18)/q2*+1/p-2/t3-,5-,6-,9-/m1../s1
InChI Key:	PVBRXXAAPNGWGE-LGVAUZIVSA-L
Melting Point:	>170°C (dec.)
Solubility:	Water (Slightly, Heated, Sonicated)
Appearance:	White to Off-White Solid
Storage:	Hygroscopic, -20°C Freezer, Under inert atmosphere
References:	Napoli, S. A., et al. J. Pharmacol. Exp. Ther., 212, 469 (1980).

Complexity:	586
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	3
Defined Atom Stereocenter Count:	4
Defined Bond Stereocenter Count:	0
Exact Mass:	407.02188792
Formal Charge:	0
Heavy Atom Count:	26
Hydrogen Bond Acceptor Count:	10
Hydrogen Bond Donor Count:	4
Isotope Atom Count:	0
Monoisotopic Mass:	407.02188792
Rotatable Bond Count:	3
Topological Polar Surface Area:	207Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0