EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

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

ChEBI Ontology
IUPAC Name 
adenosine 5'-diphosphate
Synonyms  Source
ADP trianionChEBI
5'-O-[(phosphonatooxy)phosphinato]adenosineChEBI
UniProt Name  Source
ADPUniProt
Registry NumbersSources
Beilstein:3783669Beilstein
Gmelin:341336Gmelin