Account Benzoylcoenzymealithiumsalt
- Catalog No. :
- ACTPTF376
- CAS No. :
- 102185-37-5
- Molecular Formula :
- C28H36Li4N7O17P3S
- Molecular Weight :
- 895.38
IUPAC Name:lithium (2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-(((((((R)-4-((3-((2-(benzoylthio)ethyl)amino)-3-oxopropyl)amino)-3-hydroxy-2,2-dimethyl-4-oxobutoxy)oxidophosphoryl)oxy)oxidophosphoryl)oxy)methyl)-4-hydroxytetrahydrofuran-3-yl phosphate
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Product Information
| Product Name | Benzoylcoenzymealithiumsalt |
|---|---|
| IUPAC Name | lithium (2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-(((((((R)-4-((3-((2-(benzoylthio)ethyl)amino)-3-oxopropyl)amino)-3-hydroxy-2,2-dimethyl-4-oxobutoxy)oxidophosphoryl)oxy)oxidophosphoryl)oxy)methyl)-4-hydroxytetrahydrofuran-3-yl phosphate |
| Molecular Formula | C28H36Li4N7O17P3S |
| Molecular Weight | 895.38 |
| SMILES | CC(C)(COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](N2C=NC3=C2N=CN=C3N)[C@H](O)[C@@H]1OP(=O)([O-])[O-])[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)C1=CC=CC=C1.[Li+].[Li+].[Li+].[Li+] |
| InChI Key | YQXTUVZKBYUSNS-HVGZJSRPSA-J |
| Synonym | BENZOYL COENZYME A LITHIUM SALT;coenzyme A benzoyl derivative, lithium salt;Benzoyl CoA lithium salt;BENZOYL COENZYME A LITHIUM;Benzoyl coenzyme A lithium salt >=90%;Benzoyl-CoA-sodium-salt;Benzoyl-Coenzyme A Li Salt |
| CAS No. | 102185-37-5 |
Synthetic Route by SureRoute
2. ACTPTF376 Molecular Building Block Synthetic Route
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) benzothioate
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) 4-azidobenzothioate
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) 2-aminobenzothioate