Chemical Compound

Carba-NAD

CAS Registry Number 112345-60-5
Carba-NAD chemical structure
Primary Record

Carba-NAD

In stock
7,158 g
Purity
99.2 %
CAS
112345-60-5

Compound Identifiers & Properties

CAS
112345-60-5
PubChem CID
163883
SMILES
C1[C@@H]([C@H]([C@H]([C@@H]1[N+]2=CC=CC(=C2)C(=O)N)O)O)COP(=O)([O-])OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O
Canonical SMILES
NC(=O)c1ccc[n+]([C@@H]2C[C@H](COP(=O)([O-])OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1

Names & Synonyms

  • Carba-NAD
  • Carba-NAD+
  • Carbanicotinamide adenine dinucleotide
  • RefChem:123468
  • D0JD1O
  • AC1L4TS7
  • AC1Q5J0L
  • SCHEMBL16445201
  • SCHEMBL30007671
  • C22H29N7O13P2
  • 112345-60-5
  • AR-1G9242
  • CID163883
  • C22-H29-N7-O13-P2
  • CARBA-NICOTINAMIDE-ADENINE-DINUCLEOTIDE
  • J783.386E
  • FT-0699872
  • A936503
  • [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(1R,2R,3S,4R)-4-(3-carbamoylpyridin-1-ium-1-yl)-2,3-dihydroxycyclopentyl]methyl phosphate
  • 5'-o-{[({[(1r,2r,3s,4r)-4-(3-carbamoylpyridinium-1-yl)-2,3-dihydroxycyclopentyl]methoxy}phosphinato)oxy](hydroxy)phosphoryl}adenosine
  • [[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [4-(3-carbamoylpyridin-1-ium-1-yl)-2,3-dihydroxycyclopentyl]methyl phosphate
  • 1-((1R,2S,3R,4R)-4-((((((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)hydroxyphosphoryl)oxy)oxidophosphoryl)oxy)methyl)-2,3-dihydroxycyclopentyl)-3-carbamoylpyridin-1-ium
  • 1-[(1R,2S,3R,4R)-4-{[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl phosphonato)oxy]methyl}-2,3-dihydroxycyclopentyl]-3-carbamoyl-1lambda5-pyridin-1-ylium
  • 126026-32-2
  • 3-(Aminocarbonyl)-1-[5-O-[(5 -adenylyloxy)oxylatophosphinyl]-4-O-carba-1-deoxy-beta-D-ribofuranose-1-yl]pyridinium
  • 3-Carbamoyl-1-[(1R)-4beta-[[(5 -adenylyloxy)oxylatophosphinyl]oxymethyl]-2alpha,3alpha-dihydroxycyclopentyl]pyridinium
  • Adenosine 5'-(trihydrogen diphosphate), 5'-((4-(3-(aminocarbonyl)pyridinio)-2,3-dihydroxycyclopentyl)methyl) ester, hydroxide, inner salt, (1R-(1alpha,2beta,3beta,4alpha))-
  • Adenosine 5'-(trihydrogen diphosphate), P'-[[(1R,2R,3S,4R)-4-[3-(aminocarbonyl)pyridinio]-2,3-dihydroxycyclopentyl]methyl] ester, inner salt