Chemical Compound

Q27459878

Q27459878 chemical structure
Primary Record

Q27459878

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
49866935
SMILES
CCC1=NC=CC(=C1)C(=O)[C@H]2C=CN(C=C2C(=O)N)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O
Canonical SMILES
CCc1cc(C(=O)[C@H]2C=CN([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]4O[C@@H](n5cnc6c(N)ncnc65)[C@H](O)[C@@H]4O)[C@@H](O)[C@H]3O)C=C2C(N)=O)ccn1

Names & Synonyms

  • Q27459878
  • 2-ETHYL-ISONICOTINIC-ACYL-NICOTINAMIDE-ADENINE DINUCLEOTIDE
  • {(2r,3s,4r,5r)-5-[(4s)-3-(Aminocarbonyl)-4-(2-Ethylisonicotinoyl)pyridin-1(4h)-Yl]-3,4-Dihydroxytetrahydrofuran-2-Yl}methyl [(2r,3s,4r,5r)-5-(6-Amino-9h-Purin-9-Yl)-3,4-Dihydroxytetrahydrofuran-2-Yl]methyl Dihydrogen Diphosphate