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CHEBI:18304 - deamido-NAD+

ChEBI IDCHEBI:18304
ChEBI Namedeamido-NAD+
Stars
ASCII Namedeamido-NAD(+)
Secondary ChEBI IDsCHEBI:4340, CHEBI:14103, CHEBI:14104, CHEBI:23567
Last Modified15 September 2025
DownloadsMolfile
FormulaC21H27N6O15P2
Net Charge+1
Average Mass665.422
Monoisotopic Mass665.10041
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+1/t10-,11-,13-,14-,15-,16-,19-,20-/m1/s1
InChIKeySENPVEZBRZQVST-HISDBWNOSA-O
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
deamido-NAD+ (CHEBI:18304) has role Escherichia coli metabolite (CHEBI:76971)
deamido-NAD+ (CHEBI:18304) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
deamido-NAD+ (CHEBI:18304) has role human metabolite (CHEBI:77746)
deamido-NAD+ (CHEBI:18304) has role mouse metabolite (CHEBI:75771)
deamido-NAD+ (CHEBI:18304) is a nicotinic acid dinucleotide (CHEBI:37584)
deamido-NAD+ (CHEBI:18304) is conjugate acid of deamido-NAD zwitterion (CHEBI:14105)
Incoming Relation(s)
NAD+ (CHEBI:15846) has functional parent deamido-NAD+ (CHEBI:18304)
deamido-NAD zwitterion (CHEBI:14105) is conjugate base of deamido-NAD+ (CHEBI:18304)
IUPAC Name 
adenosine 5'-{3-[1-(3-carboxypyridinio)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate}
Synonyms  Source
Deamino-NAD+KEGG COMPOUND
Deamido-NAD+KEGG COMPOUND
Deamido-NADKEGG COMPOUND
nicotinic acid-adenine dinucleotideChEBI
nicotinic acid adenine dinucleotideKEGG COMPOUND
desamido NADChEBI
Manual XrefsDatabases
C00857KEGG COMPOUND
DB04099DrugBank
NXXPDBeChem
HMDB0001179HMDB
FDB031057FooDB
Registry NumbersSources
CAS:6450-77-7ChEBI