Terminology Service for NFDI4Health

4-hydroxybenzoyl-AMP(1-)

Go to external page http://purl.obolibrary.org/obo/CHEBI_86435


An organophosphate oxoanion obtained by deprotonation of the phosphate OH group of 4-hydroxybenzoyl-AMP; the major species at pH 7.3.

Term info

Label

4-hydroxybenzoyl-AMP(1-)

Synonyms
  • 5'-O-{[(4-hydroxybenzoyl)oxy]phosphinato}adenosine
database cross reference
Subsets

3_STAR

IUPAC NAME
5'-O-{[(4-hydroxybenzoyl)oxy]phosphinato}adenosine [ IUPAC ]

charge

-1

formula

C17H17N5O9P

has obo namespace

chebi_ontology

has related synonym

4-hydroxybenzoyl-5'-AMP

id

CHEBI:86435

inchi

InChI=1S/C17H18N5O9P/c18-14-11-15(20-6-19-14)22(7-21-11)16-13(25)12(24)10(30-16)5-29-32(27,28)31-17(26)8-1-3-9(23)4-2-8/h1-4,6-7,10,12-13,16,23-25H,5H2,(H,27,28)(H2,18,19,20)/p-1/t10-,12-,13-,16-/m1/s1

inchikey

DMJCKNFAONBFQI-XNIJJKJLSA-M

mass

466.31930

monoisotopicmass

466.07694

smiles

Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP([O-])(=O)OC(=O)c2ccc(O)cc2)[C@@H](O)[C@H]1O