PSB 1114
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- structure.search.product.name PSB 1114
- Product Code: TRC-P839275
- CAS Number: 1657025-60-9
- Brand: TRC
Product Overview
Product Code
TRC-P839275
CAS Number
Product Format
Neat
Molecular Formula
C10 H11 F2 N2 Na4 O13 P3 S
Molecular Weight
622.142
Product Categories
Product Type
Bioactive Small MoleculeDocumentation
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Product Information
Chemical Data
Analyte Name
(((2R,3S,4R)-3,4-dihydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl)methoxy-((disodiooxyphosphoryl(difluoro)methyl)-sodiooxyphosphoryl)oxyphosphoryl)oxysodium
CAS Number
1657025-60-9
Molecular Formula
C10 H11 F2 N2 Na4 O13 P3 S
Molecular Weight
622.142
Accurate Mass
621.875
SMILES
O[C@H]1[C@@H](O)C(O[C@@H]1COP(=O)(O[Na])OP(=O)(O[Na])C(F)(F)P(=O)(O[Na])O[Na])N2C=CC(=S)NC2=O
InChI
InChI=1S/C10H15F2N2O13P3S.4Na/c11-10(12,28(18,19)20)29(21,22)27-30(23,24)25-3-4-6(15)7(16)8(26-4)14-2-1-5(31)13-9(14)17;;;;/h1-2,4,6-8,15-16H,3H2,(H,21,22)(H,23,24)(H,13,17,31)(H2,18,19,20);;;;/q;4*+1/p-4/t4-,6-,7-,8?;;;;/m1..../s1
IUPAC
[[(2R,3S,4R)-3,4-dihydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-[[disodiooxyphosphoryl(difluoro)methyl]-sodiooxyphosphoryl]oxyphosphoryl]oxysodium
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Bioactive Small Molecule
Product Format
Neat
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