Phenylacetyl Coenzyme A, Sodium salt

Compound Identifiers & Properties

PubChem CID

172992006

SMILES

CC(C)(COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)[O-])C(C(=O)NCCC(=O)NCCSC(=O)CC4=CC=CC=C4)O.[Na+].[Na+].[Na+]

Canonical SMILES

CC(C)(COP(=O)([O-])OP(=O)([O-])OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)([O-])O)C(O)C(=O)NCCC(=O)NCCSC(=O)Cc1ccccc1.[Na+].[Na+].[Na+]