trisodium;(2S,3S,4S,5R,6R)-6-[[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl]oxy-oxidophosphoryl]oxy-3,4,5-trihydroxyoxane-2-carboxylate


Chemical Name: trisodium;(2S,3S,4S,5R,6R)-6-[[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl]oxy-oxidophosphoryl]oxy-3,4,5-trihydroxyoxane-2-carboxylate
CAS Number: 63700-19-6
Product Number: AG00ECRX(AGN-PC-00US37)
Synonyms:
MDL No: MFCD03452710
Molecular Formula: C15H19N2Na3O18P2
Molecular Weight: 646.2308

Identification/Properties


Properties
MP:
>175ºC (dec.)
Storage:
Keep in dry area;-10 ℃;Inert atmosphere;
Form:
Solid
Solubility:
H2O: 10 mg/mL, clear, colorless
Computed Properties
Molecular Weight:
646.23g/mol
Hydrogen Bond Donor Count:
6
Hydrogen Bond Acceptor Count:
18
Rotatable Bond Count:
8
Exact Mass:
645.98g/mol
Monoisotopic Mass:
645.98g/mol
Topological Polar Surface Area:
317A^2
Heavy Atom Count:
40
Formal Charge:
0
Complexity:
1020
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
9
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
4
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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