Chemical Compound

CHEMBL1775007

CHEMBL1775007 chemical structure
Primary Record

CHEMBL1775007

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
54580986
SMILES
CC1=CC=C(C=C1)C2=NC3=C(N=CN=C3N2[C@H]4[C@@H]([C@@H]([C@H](O4)COP(=O)([O-])OP(=O)([O-])OC[C@@H]5[C@H]([C@H]([C@@H](O5)[N+]6=CC=CC(=C6)C(=O)N)O)O)O)O)N
Canonical SMILES
Cc1ccc(-c2nc3c(N)ncnc3n2[C@@H]2O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]3O[C@@H]([n+]4cccc(C(N)=O)c4)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)cc1

Names & Synonyms

  • CHEMBL1775007
  • BDBM50343902
  • 8-(4-Methylphenyl)-Nicotinamide adenine dinucleotide