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Reference substances

Reference substances

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IUPAC name:
Sodium[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl({[2-(trimethylazaniumyl)ethyl]phosphanato}oxy)phophonate

Inventory

EC number:
251-689-1
EC name:
Cytidine 5'-(trihydrogen diphosphate), mono[2-(trimethylammonio)ethyl] ester, hydroxide, inner salt, monosodium salt
CAS number:
33818-15-4
CAS number:
33818-15-4

Synonyms

Molecular and structural information

Molecular formula:
C14H26N4O11P2.Na
Molecular weight:
510.308
SMILES notation:
[Na+].C[N+](C)(C)CCOP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@@H](N1C=CC(N)=NC1=O)[C@H](O)[C@@H]2O
InChl:
InChI=1/C14H26N4O11P2.Na/c1-18(2,3)6-7-26-30(22,23)29-31(24,25)27-8-9-11(19)12(20)13(28-9)17-5-4-10(15)16-14(17)21;/h4-5,9,11-13,19-20H,6-8H2,1-3H3,(H3-,15,16,21,22,23,24,25);/q;+1/p-1/t9-,11-,12-,13-;/m1./s1
Structural formula:
Chemical structure

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