CHEBI:57540 - NAD(1−)

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ChEBI Name NAD(1−)
ChEBI ID CHEBI:57540
ChEBI ASCII Name NAD(1-)
Definition An anionic form of nicotinamide adenine dinucleotide arising from deprotonation of the two OH groups of the diphosphate moiety.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C21H26N7O14P2
Net Charge -1
Average Mass 662.41720
Monoisotopic Mass 662.101
InChI InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p-1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1
InChIKey BAWFJGJZGIEFAR-NNYOXOHSSA-M
SMILES NC(=O)c1ccc[n+](c1)[C@@H]1O[C@H](COP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1O
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:4932) Source: yeast.sf.net See: PubMed
Homo sapiens (NCBI:9606) See: DOI
Roles Classification
Biological Role(s): 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).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing NAD(1−) (CHEBI:57540) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
NAD(1−) (CHEBI:57540) has role human metabolite (CHEBI:77746)
NAD(1−) (CHEBI:57540) is a organophosphate oxoanion (CHEBI:58945)
NAD(1−) (CHEBI:57540) is conjugate base of NAD+ (CHEBI:15846)
Incoming NAD+ (CHEBI:15846) is conjugate acid of NAD(1−) (CHEBI:57540)
IUPAC Name
adenosine 5'-{3-[1-(3-carbamoylpyridinio)-1,4-anhydro-D-ribitol-5-yl] diphosphate}
Synonyms Sources
NAD anion ChEBI
NAD+ UniProt
Registry Numbers Types Sources
3868403 Beilstein Registry Number Beilstein
684342 Gmelin Registry Number Gmelin
Last Modified
21 January 2016