8-Azido-[alpha-32P]ATP

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Basic information

CAS: 117145-99-0
Standard SMILES: [N-]=[N+]=Nc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO[32P](=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O
InChIKey: PQISXOFEOCLOCT-IJQGFWEMSA-N
Molecular formula: C10H15N8O13P3
Average molar mass: 549.19 g/mol
Monoisotopic mass: 548.9972892

Names & identifiers

Preferred name: 8-Azido-[alpha-32P]ATP
IUPAC: [[(2R,3S,4R,5R)-5-(6-amino-8-azidopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxy(32P)phosphoryl] phosphono hydrogen phosphate

Names & synonyms

117145-99-08-Azidoadenosine 5'-(tetrahydrogen triphosphate)8-Azido-[alpha-32P]ATPDTXSID203493678-Azidoadenosine-[alpha-32P]triphosphate8-Azidoadenosine 5'-[alpha-32P]triphosphateAdenosine 5'-(tetrahydrogen [alpha-32P]triphosphate), 8-azidoAdenosine 5'-(tetrahydrogen triphosphate-P-32P), 8-azido- (9CI)adenosine, 8-azido-, 5'-(tetrahydrogen [alpha-32P]triphosphate)[[(2R,3S,4R,5R)-5-(6-amino-8-azidopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxy(32P)phosphoryl] phosphono hydrogen phosphate

Database identifiers

CAS: 117145-99-0
PubChem CID: 644309
DTXSID: DTXSID20349367
Nikkaji: J671.749G

Properties

Computed structural properties

XLogP: -4.4
Topological polar surface area: 293 Å²
Hydrogen bond donors: 7
Hydrogen bond acceptors: 19
Rotatable bonds: 9
Heavy atoms: 34
Formal charge: 0
Complexity: 948

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Compound notes

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