Account Coenzyme A, S-[(5Z,8Z,11Z,14Z)-5,8,11,14-eicosatetraenoate], triammonium salt
- Catalog No. :
- ACXCDP890
- CAS No. :
- 799812-93-4
- Molecular Formula :
- C41H69N8O17P3S
- Molecular Weight :
- 1071.03
IUPAC Name:S-(2-(3-((2R)-4-(((((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-2-hydroxy-3,3-dimethylbutanamido)propanamido)ethyl) (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenethioate, ammonia salt
![Coenzyme A, S-[(5Z,8Z,11Z,14Z)-5,8,11,14-eicosatetraenoate], triammonium salt structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | Coenzyme A, S-[(5Z,8Z,11Z,14Z)-5,8,11,14-eicosatetraenoate], triammonium salt |
|---|---|
| IUPAC Name | S-(2-(3-((2R)-4-(((((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-2-hydroxy-3,3-dimethylbutanamido)propanamido)ethyl) (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenethioate, ammonia salt |
| Molecular Formula | C41H69N8O17P3S |
| Molecular Weight | 1071.03 |
| SMILES | O[C@@H]1[C@@H]([C@H](O[C@@]1([H])N1C=NC2=C(N=CN=C12)N)COP(O)(=O)OP(O)(=O)OCC(C)(C)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OP(O)(O)=O.N |
| InChI Key | YVBZXCINIRRXIS-PPXCCCNFSA-N |
| Synonym | DTXSID60677196 | PUBCHEM_46907897 | 20:4 Coenzyme A, (5Z,8Z,11Z,14Z-eicosatetraenoyl) Coenzyme A (ammonium salt), powder |
| CAS No. | 799812-93-4 |
| PubChem CID | 46907897 |
Synthetic Route by SureRoute
2. ACXCDP890 Molecular Building Block Synthetic Route
lithium (2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-(((hydroxy((hydroxy((R)-3-hydroxy-4-((3-((2-(((5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoyl)thio)ethyl)amino)-3-oxopropyl)amino)-2,2-dimethyl-4-oxobutoxy)phosphoryl)oxy)phosphoryl)oxy)methyl)tetrahydrofuran-3-yl hydrogen phosphate
Coenzyme A, S-(5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-eicosapentaenoate, ammonium salt (1:3)
5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-((((((3-hydroxy-2,2-dimethyl-4-oxo-4-((3-oxo-3-((2-(tetratriaconta-16,19,22,25,28-pentaenoylthio)ethyl)amino)propyl)amino)butoxy)oxidophosphoryl)oxy)oxidophosphoryl)oxy)methyl)tetrahydrofuran-3-yl phosphate