NICOTINAMIDE ADENINE DINUCLEOTIDE CYCLOHEXANONE

Compound Identifiers & Properties

PubChem CID

46936590

SMILES

C1CCC(=O)[C@@H](C1)C2=C(C=[N+](C=C2)[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)C(=O)N

Canonical SMILES

NC(=O)c1c[n+]([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)ccc1[C@@H]1CCCCC1=O