isonicotinic-acetyl-nicotinamide-adenine dinucleotide

Compound Identifiers & Properties

PubChem CID

91754233

SMILES

C1=CN(C=C([C@H]1C(C2=CC=NC=C2)O)C(=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

NC(=O)C1=CN([C@@H]2O[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)C=C[C@@H]1C(O)c1ccncc1