EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:169970 - 2-hydroxy-ATP(4−)

ChEBI IDCHEBI:169970
ChEBI Name2-hydroxy-ATP(4−)
Stars
ASCII Name2-hydroxy-ATP(4-)
DefinitionA nucleoside triphosphate(4−) obtained by global deprotonation of the triphosphate OH groups of 2-hydroxy-ATP; major species present at pH 7.3.
Last Modified20 April 2021
SubmitterAdnan
DownloadsMolfile
FormulaC10H12N5O14P3
Net Charge-4
Average Mass519.149
Monoisotopic Mass518.96155
SMILESNc1nc(O)nc2c1ncn2[C@@H]1O[C@H](COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])[C@@H](O)[C@H]1O
InChIInChI=1S/C10H16N5O14P3/c11-7-4-8(14-10(18)13-7)15(2-12-4)9-6(17)5(16)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H,24,25)(H2,19,20,21)(H3,11,13,14,18)/p-4/t3-,5-,6-,9-/m1/s1
InChIKeyDJHOBIUAJLDRDQ-UUOKFMHZSA-J
ChEBI Ontology
Outgoing Relation(s)
2-hydroxy-ATP(4−) (CHEBI:169970) is a nucleoside 5'-triphoshate(4−) (CHEBI:61557)
2-hydroxy-ATP(4−) (CHEBI:169970) is conjugate base of 2-hydroxy-ATP (CHEBI:65119)
2-hydroxy-ATP(4−) (CHEBI:169970) is tautomer of 2-oxo-ATP(4−) (CHEBI:172878)
Incoming Relation(s)
2-hydroxy-ATP (CHEBI:65119) is conjugate acid of 2-hydroxy-ATP(4−) (CHEBI:169970)
2-oxo-ATP(4−) (CHEBI:172878) is tautomer of 2-hydroxy-ATP(4−) (CHEBI:169970)
IUPAC Name 
2-hydroxy-5'-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)adenosine
Synonyms  Source
2-hydroxyadenosine 5'-triphosphate tetraanionChEBI
2-hydroxy-ATP tetraanionChEBI
UniProt Name  Source
2-hydroxy-ATPUniProt