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CHEBI:58349 - NADP(3−)

ChEBI IDCHEBI:58349
ChEBI NameNADP(3−)
Stars
ASCII NameNADP(3-)
DefinitionAn organophosphate oxoanion arising from deprotonation of the phosphate and diphosphate OH groups of NADP+; major species at pH 7.3.
Last Modified26 July 2019
DownloadsMolfile
FormulaC21H25N7O17P3
Net Charge-3
Average Mass740.385
Monoisotopic Mass740.05362
SMILESNC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)([O-])[O-])[C@@H]3O)[C@@H](O)[C@H]2O)c1
InChIInChI=1S/C21H28N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39)/p-3/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1
InChIKeyXJLXINKUBYWONI-NNYOXOHSSA-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
Chemical Role:
electron acceptor  A substance to which an electron may be transferred.
Biological Roles:
cofactor  An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group).
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
NADP(3−) (CHEBI:58349) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
NADP(3−) (CHEBI:58349) has role cofactor (CHEBI:23357)
NADP(3−) (CHEBI:58349) has role human metabolite (CHEBI:77746)
NADP(3−) (CHEBI:58349) is a hydrogen acceptor (CHEBI:13193)
NADP(3−) (CHEBI:58349) is a organophosphate oxoanion (CHEBI:58945)
NADP(3−) (CHEBI:58349) is conjugate base of NADP+ (CHEBI:18009)
Incoming Relation(s)
NADP+ (CHEBI:18009) is conjugate acid of NADP(3−) (CHEBI:58349)
IUPAC Name 
2'-O-phosphonatoadenosine 5'-{3-[1-(3-carbamoylpyridinio)-1,4-anhydro-D-ribitol-5-yl] diphosphate}
Synonym  Source
NADP trianionChEBI
UniProt Name  Source
NADP+UniProt
Registry NumbersSources
Reaxys:4122171Reaxys