NAD
NAD synonyms
Nicotinamide dinucleotide; Codehydrase I; DPN; Nicotineamide adenine dinucleotide; beta-Nicotinamide adenine dinucleotide; Nicotinamide adenine dinucleotide; Nadide [USAN:BAN:INN:JAN]; Enzopride; CO-1; Oxidized diphosphopyridine nucleotide; NAD+
Graphical representations:
View large 3D structure
Molecular Formula: C21H28N7O14P2+
Natural Isotopic Abundance Mass: 664.433042
Mono-Isotopic Molecular Masses:
- C12N14: 664.1169466646
- C13N14: 685.1873982584
- C12N15: 671.096190917
- C13N15: 692.1666425108
InChI string: 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
IUPAC: [(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-[[(2R,3R,4R,5R)-5-(5-carbamoylpyridin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-oxido-phosphoryl]oxy-phosphinic acid
PubChem Compound (CID): 5892KEGG Compound ID: C00003
CAS Registry number: 159929-29-0 30429-30-2 53-84-9
ChEBI: 15846
EINECS: 200-184-4
NSC: 20272
Beilstein Handbook Reference: 5-26-16-00399
PDB Compound ID: NAD NAH NAJ
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.
InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)