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CHEBI:182532 - Adenosine 5'-phosphosulfate sodium salt

ChEBI IDCHEBI:182532
ChEBI NameAdenosine 5'-phosphosulfate sodium salt
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SubmitterMetaboLights
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FormulaC10H13N5O10PS.Na
Net Charge0
Average Mass449.270
Monoisotopic Mass449.00184
SMILESNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OS(=O)(=O)[O-])[C@@H](O)[C@H]1O.[Na+]
InChIInChI=1S/C10H14N5O10PS.Na/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-26(18,19)25-27(20,21)22;/h2-4,6-7,10,16-17H,1H2,(H,18,19)(H2,11,12,13)(H,20,21,22);/q;+1/p-1/t4-,6-,7-,10-;/m1./s1
InChIKeyJYPWXEPVDQGNMS-MCDZGGTQSA-M
ChEBI Ontology
Outgoing Relation(s)
Adenosine 5'-phosphosulfate sodium salt (CHEBI:182532) is a purine ribonucleoside monophosphate (CHEBI:26397)
IUPAC Name 
sodium;[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] sulate
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17346283ChemSpider