Account Coenzyme A, S-hexacosanoate, triammonium salt
- Catalog No. :
- ACILXB175
- CAS No. :
- 799813-02-8
- Molecular Formula :
- C47H89N8O17P3S
- Molecular Weight :
- 1163.26
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) hexacosanethioate, ammonia salt
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Product Information
| Product Name | Coenzyme A, S-hexacosanoate, 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) hexacosanethioate, ammonia salt |
| Molecular Formula | C47H89N8O17P3S |
| Molecular Weight | 1163.26 |
| 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)CCCCCCCCCCCCCCCCCCCCCCCCC)OP(O)(O)=O.N |
| InChI Key | CUCATJVITWFMDZ-IZDQXAIESA-N |
| Synonym | 799813-02-8 | CID 46907906 | DTXSID50677201 | 26:0 Coenzyme A, hexacosanoyl Coenzyme A (ammonium salt), powder | triazanium;[(2R,3R,5R)-5-(6-aminopurin-9-yl)-2-[[[[(3R)-4-[[3-(2-hexacosanoylsulfanylethylamino)-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy |
| CAS No. | 799813-02-8 |
| PubChem CID | 46907906 |
Synthetic Route by SureRoute
2. ACILXB175 Molecular Building Block Synthetic Route
Myristoyl coenzyme A
Coenzyme A, S-dodecanoate, ammonium salt (1:3)
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) tetradecanethioate xlithium salt