EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:58437 - deamido-NAD(2−)

ChEBI IDCHEBI:58437
ChEBI Namedeamido-NAD(2−)
Stars
ASCII Namedeamido-NAD(2-)
DefinitionDianion of deamido-NAD+ arising from deprotonation of phosphate and carboxylic acid functions.
Last Modified15 September 2025
DownloadsMolfile
FormulaC21H24N6O15P2
Net Charge-2
Average Mass662.398
Monoisotopic Mass662.07858
SMILESNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]2O[C@@H]([n+]3cccc(C(=O)[O-])c3)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O
InChIInChI=1S/C21H26N6O15P2/c22-17-12-18(24-7-23-17)27(8-25-12)20-16(31)14(29)11(41-20)6-39-44(36,37)42-43(34,35)38-5-10-13(28)15(30)19(40-10)26-3-1-2-9(4-26)21(32)33/h1-4,7-8,10-11,13-16,19-20,28-31H,5-6H2,(H4-,22,23,24,32,33,34,35,36,37)/p-2/t10-,11-,13-,14-,15-,16-,19-,20-/m1/s1
InChIKeySENPVEZBRZQVST-HISDBWNOSA-L
ChEBI Ontology
Outgoing Relation(s)
deamido-NAD(2−) (CHEBI:58437) is a organophosphate oxoanion (CHEBI:58945)
deamido-NAD(2−) (CHEBI:58437) is conjugate base of deamido-NAD zwitterion (CHEBI:14105)
Incoming Relation(s)
deamido-NAD zwitterion (CHEBI:14105) is conjugate acid of deamido-NAD(2−) (CHEBI:58437)
IUPAC Name 
adenosine 5'-{3-[1-(3-carboxypyridinio)-1,4-anhydro-D-ribitol-5-yl] diphosphate}
Synonyms  Source
NAAD(2−)ChEBI
nicotinic acid adenine dinucleotide(2−)ChEBI
NaAD(2−)ChEBI
UniProt Name  Source
deamido-NAD+UniProt
Citations