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adenosine 3',5'-diphosphate

Structure via PubChem · Public domain (PubChem)

EntityQ2825485· pop 9· linked from 34 articles

adenosine 3',5'-diphosphate

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Also known as adenosine 3',5'-bisphosphate, 5-(Dihydrogen phosphate) 3-Adenylate, {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}phosphonic acid, 3'-Phosphoryl-AMP, Adenosine 3,5-bisphosphate, 3,5-Diphosphoadenosine, 5-(Dihydrogen phosphate)3'-Adenylic acid, Adenosine 3,5-bis

chemical compound

Chemical data

Formula
C10H15N5O10P2
Molecular weight
427.2 g/mol
IUPAC name
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate
SMILES
C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)OP(=O)(O)O)O)N
InChIKey
WHTCPDAXWFLDIH-KQYNXXCUSA-N
XLogP
-4.6
Polar surface area
233 Ų
H-bond donors
6
H-bond acceptors
14
Formal charge
0

via PubChem

Drug data · ChEMBL

Molecule type
Small molecule

via ChEMBL · EBI

Wikidata facts

Mass
427.029
Show 5 more facts
chemical formula
C₁₀H₁₅N₅O₁₀P₂
isomeric SMILES
C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)OP(=O)(O)O)O
canonical SMILES
C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)COP(=O)(O)O)OP(=O)(O)O)O
found in taxon
Escherichia coli
Commons category
Adenosine 3',5'-bisphosphate
Sources (2)

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