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CHEBI:456216 - ADP(3−)

ChEBI IDCHEBI:456216
ChEBI NameADP(3−)
Stars
ASCII NameADP(3-)
DefinitionA nucleoside 5'-diphosphate(3−) arising from deprotonation of all three diphosphate OH groups of adenosine 5'-diphosphate (ADP); major species present at pH 7.3.
Last Modified13 March 2017
DownloadsMolfile
FormulaC10H12N5O10P2
Net Charge-3
Average Mass424.179
Monoisotopic Mass424.00759
SMILESNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)([O-])OP(=O)([O-])[O-])[C@@H](O)[C@H]1O
InChIInChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1
InChIKeyXTWYTFMLZFPYCI-KQYNXXCUSA-K
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
fundamental metabolite  Any metabolite produced by all living cells.
ChEBI Ontology
Outgoing Relation(s)
ADP(3−) (CHEBI:456216) has role fundamental metabolite (CHEBI:78675)
ADP(3−) (CHEBI:456216) has role human metabolite (CHEBI:77746)
ADP(3−) (CHEBI:456216) is a nucleoside 5'-diphosphate(3−) (CHEBI:57930)
ADP(3−) (CHEBI:456216) is conjugate base of ADP (CHEBI:16761)
ADP(3−) (CHEBI:456216) is conjugate base of ADP(2−) (CHEBI:87518)
Incoming Relation(s)
9-ribosyl-trans-zeatin 5'-diphosphate(3−) (CHEBI:87950) has functional parent ADP(3−) (CHEBI:456216)
ADP-5-ethyl-4-methylthiazole-2-carboxylate(3−) (CHEBI:139151) has functional parent ADP(3−) (CHEBI:456216)
ADP (CHEBI:16761) is conjugate acid of ADP(3−) (CHEBI:456216)
ADP(2−) (CHEBI:87518) is conjugate acid of ADP(3−) (CHEBI:456216)
IUPAC Name 
adenosine 5'-diphosphate
Synonyms  Source
ADP trianionChEBI
5'-O-[(phosphonatooxy)phosphinato]adenosineChEBI
UniProt Name  Source
ADPUniProt
Registry NumbersSources
Beilstein:3783669Beilstein
Gmelin:341336Gmelin