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Structure

3'-Phosphoadenosine 5'-phosphate

CAS
75431-54-8
Catalog Number
ACM75431548
Category
Other Products
Molecular Weight
471.16
Molecular Formula
C10H13N5Na2O10P2

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Specification

Synonyms
CCRIS 7509, 3-Phosphoadenosine 5-phosphate, 1053-73-2 (Parent), 75431-54-8
IUPAC Name
[6-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]-4H-purin-3-yl]phosphonic acid
Canonical SMILES
C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)COP(=O)(O)[O-])OP(=O)(O)[O-])O.[Na+].[Na+]
InChI Key
XVGAAHGKQIVCHH-AFPKLJJXSA-N
Exact Mass
470.99300
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
15
H-Bond Donor
7
Safety Description
26-27-36
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