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Chemical structure of Adenosine 5'-phosphosulfate (sodium salt)

GC42734

Adenosine 5'-phosphosulfate (sodium salt)

Adenosine 5'-phosphosulfate is an ATP and sulfate competitive inhibitor of ATP sulfurylase in humans, S· cerevisiae, and P· chrysogenum (Ki = 18, 2500, and 1500 nM, respectively)

ChemicalCAS102029-95-8MW473.3FormulaC10H14N5O10PS•2Na
CAS number
102029-95-8
Molecular weight
473.3
Formula
C10H14N5O10PS•2Na
Solubility
PBS (pH 7·2)： 10 mg/ml
InChIKey
AVYOIJBTXNOSSY-IDIVVRGQSA-N
Catalogue number
GC42734
Brand
GLPBIO
Computed properties PubChem CID 131864825 · TPSA 238 Ų · H-bond donors 5 · H-bond acceptors 14
TPSA
238 Ų
H-bond donors
5
H-bond acceptors
14
Rotatable bonds
6
Heavy atoms
29

SMILES C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OS(=O)(=O)O)O)O)N.[Na].[Na]

Computed descriptors from PubChem (CID 131864825), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Documents
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