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CHEBI:44672 - 3'-phosphate-adenosine-5'-diphosphate

ChEBI IDCHEBI:44672
ChEBI Name3'-phosphate-adenosine-5'-diphosphate
Stars
DefinitionAn adenosine 3'-phosphate that is ADP carrying a phospate group at the 3'-position. It is potent inhibitor of bovine pancreatic ribonuclease A.
Last Modified3 June 2024
DownloadsMolfile
FormulaC10H16N5O13P3
Net Charge0
Average Mass507.182
Monoisotopic Mass506.99575
SMILESNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O
InChIInChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7(27-29(17,18)19)4(26-10)1-25-31(23,24)28-30(20,21)22/h2-4,6-7,10,16H,1H2,(H,23,24)(H2,11,12,13)(H2,17,18,19)(H2,20,21,22)/t4-,6-,7-,10-/m1/s1
InChIKeyGBBWIZKLHXYJOA-KQYNXXCUSA-N
ChEBI Ontology
Outgoing Relation(s)
3'-phosphate-adenosine-5'-diphosphate (CHEBI:44672) has functional parent ADP (CHEBI:16761)
3'-phosphate-adenosine-5'-diphosphate (CHEBI:44672) is a adenosine 3'-phosphate (CHEBI:37097)
3'-phosphate-adenosine-5'-diphosphate (CHEBI:44672) is a adenosine 5'-phosphate (CHEBI:37096)
Incoming Relation(s)
coenzyme A (CHEBI:15346) has functional parent 3'-phosphate-adenosine-5'-diphosphate (CHEBI:44672)
IUPAC Name 
adenosine 3'-(dihydrogen phosphate) 5'-(trihydrogen diphosphate)
Synonyms  Source
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-oxolan-2-yl]methyl phosphono hydrogen phosphatePDBeChem
adenosine 3'-phosphate 5'-diphosphateChEBI
5'-diphosphoadenosine 3'-phosphateChEBI
Manual XrefsDatabases
PAPPDBeChem
Registry NumbersSources
CAS:13400-10-7ChEBI
Citations