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NADP sodium salt

CAT: 0013-GTR19157508-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19157508-01Size:1 g
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Description
NADP sodium salt is a coenzyme that is widely distributed in living matter. Participates in oxidation-reduction reactions.
CAS Number
1184-16-3
Product Name Alternative
Sodium NADP
Purity
>98% (HPLC)
Solubility
H2O:150 mg/mL (195.98 mM; Need ultrasonic)
Smiles
[Na+].NC (=O) c1ccc[n+] (c1) [C@@H]1O[C@H] (COP ([O-]) (=O) OP ([O-]) (=O) OC[C@H]2O[C@H] ([C@H] (OP (O) (O) =O) [C@@H]2O) n2cnc3c (N) ncnc23) [C@@H] (O) [C@H]1O
Molecular Formula
C21H27N7NaO17P3
Molecular Weight
765.39
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Nadide phosphate monosodium
CAS Number1184-16-3
PubChem CID5702267
IUPAC Namesodium [(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-5-[[[[(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-4-hydroxyoxolan-3-yl] hydrogen phosphate
Molecular FormulaC21H27N7NaO17P3
Molecular Weight765.4
Topological Polar Surface Area370
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count21
Rotatable Bond Count13
Heavy Atom Count49
Formal Charge0
Complexity1290
SMILES
C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)OP(=O)(O)[O-])O)O)O)C(=O)N.[Na+]
InChI
InChI=1S/C21H28N7O17P3.Na/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32;/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39);/q;+1/p-1/t10-,11-,13-,14-,15-,16-,20-,21-;/m1./s1
InChIKey
JNUMDLCHLVUHFS-QYZPTAICSA-M
Chemical Structure
2D Structure
2D structure of Nadide phosphate monosodium
CAS: 1184-16-3
CID: 5702267
Formula: C21H27N7NaO17P3
MW: 765.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight765.4
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count21
Rotatable Bond Count13
Exact Mass765.05739769
Monoisotopic Mass765.05739769
Topological Polar Surface Area370 Ų
Heavy Atom Count49
Formal Charge0
Complexity1290
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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