Primary Record
Acetoacetyl-CoANa3
- In stock
- 6,803 g
- Purity
- 99.7 %
- CAS
- 102029-52-7
Compound Identifiers & Properties
- CAS
- 102029-52-7
- PubChem CID
- 16218855
- SMILES
- CC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)([O-])OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)([O-])[O-])O.[Na+].[Na+].[Na+]
- Canonical SMILES
- CC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)([O-])OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-].[Na+].[Na+].[Na+]
Names & Synonyms
- Acetoacetyl-CoANa3
- Acetoacetyl-CoA*xNa
- Acetoacetyl coenzyme A sodium salt
- Acetoacetyl coenzyme A sodium salt hydrate
- 102029-52-7