04:0 Pyrene Coenzyme A, 1-pyrenebutanoyl Coenzyme A (ammonium salt), powder

Compound Identifiers & Properties

PubChem CID

136212466

SMILES

CC(C)(COP(=O)([O-])OP(=O)([O-])OC[C@@H]1[C@@H](C([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)[O-])[C@H](C(=O)NCCC(=O)NCCSC(=O)CCCC4=C5C=CC6=CC=CC7=C6C5=C(C=C7)C=C4)O.[NH4+].[NH4+].[NH4+]

Canonical SMILES

CC(C)(COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)C(O)[C@H]1OP(=O)([O-])O)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CCCc1ccc2ccc3cccc4ccc1c2c34.[NH4+].[NH4+].[NH4+]