CAS Registry Number®
53-84-9
CAS Name
NAD
Molecular Formula
C21H27N7O14P2
Compound Properties
-
Melting Point (1)
140-142 °C (decomp)
Source(s)
- (1) Winer, Alfred D.; Journal of Biological Chemistry, (1964), 239(10), PC3598-PC3600, CAplus
Other Names and Identifiers
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)
InChIKey
InChIKey=BAWFJGJZGIEFAR-UHFFFAOYSA-N
SMILES
OC1C(N2C=3C(N=C2)=C(N)N=CN3)OC(COP(OP(OCC4OC(C(O)C4O)[N+]=5C=C(C(N)=O)C=CC5)(=O)[O-])(=O)O)C1O
Canonical SMILES
O=C(N)C1=CC=C[N+](=C1)C2OC(COP(=O)([O-])OP(=O)(O)OCC3OC(N4C=NC=5C(=NC=NC54)N)C(O)C3O)C(O)C2O
Other Names for this Substance
- Adenosine 5′-(trihydrogen diphosphate), P′→5′-ester with 3-(aminocarbonyl)-1-β-D-ribofuranosylpyridinium, inner salt
- Pyridinium, 3-carbamoyl-1-β-D-ribofuranosyl-, hydroxide, 5′→5′-ester with adenosine 5′-(trihydrogen pyrophosphate), inner salt
- Adenosine 5′-(trihydrogen diphosphate), P′→5′-ester with 3-(aminocarbonyl)-1-β-D-ribofuranosylpyridinium hydroxide, inner salt
- Codehydrase I
- Codehydrogenase I
- Coenzyme I
- Diphosphopyridine nucleotide
- DPN
- Cozymase I
- NAD
- Nadide
- Nicotinamide-adenine dinucleotide
- Oxidized diphosphopyridine nucleotide
- Adenine-nicotinamide dinucleotide
- NAD+
- Enzopride
- β-NAD
- β-Diphosphopyridine nucleotide
- β-Nicotinamide adenine dinucleotide
- β-NAD+
- NSC 20272
- CO-I
- β-Nicotinamide adenine dinucleotide hydrate
- MeSH ID: D009243
Deleted or Replaced CAS Registry Numbers
30429-30-2, 159929-29-0, 1083039-67-1, 1354693-98-3
