Account S-(2-(3-(4-((((((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) 3-methylbut-2-enethioate, lithium salt
- Catalog No. :
- ACXZEH912
- CAS No. :
- 108347-83-7
- Molecular Formula :
- C26H38Li4N7O17P3S
- Molecular Weight :
- 873.38
IUPAC Name:lithium 5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-((((((3-hydroxy-2,2-dimethyl-4-((3-((2-((3-methylbut-2-enoyl)thio)ethyl)amino)-3-oxopropyl)amino)-4-oxobutoxy)oxidophosphoryl)oxy)oxidophosphoryl)oxy)methyl)tetrahydrofuran-3-yl phosphate
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Product Information
| Product Name | S-(2-(3-(4-((((((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) 3-methylbut-2-enethioate, lithium salt |
|---|---|
| IUPAC Name | lithium 5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-((((((3-hydroxy-2,2-dimethyl-4-((3-((2-((3-methylbut-2-enoyl)thio)ethyl)amino)-3-oxopropyl)amino)-4-oxobutoxy)oxidophosphoryl)oxy)oxidophosphoryl)oxy)methyl)tetrahydrofuran-3-yl phosphate |
| Molecular Formula | C26H38Li4N7O17P3S |
| Molecular Weight | 873.38 |
| SMILES | CC(C)=CC(SCCNC(CCNC(C(O)C(C)(C)COP([O-])(OP([O-])(OCC1OC(N2C=NC3=C(N)N=CN=C23)C(O)C1OP([O-])([O-])=O)=O)=O)=O)=O)=O.[Li+].[Li+].[Li+].[Li+] |
| InChI Key | GOAUDLLOUVLYIJ-UHFFFAOYSA-J |
| Synonym | DTXSID90585215 | BETA-METHYLCROTONYL COENZYME A LITHIUM SALT | beta-Methylcrotonyl coenzyme A lithium salt, >=90% | (C5:1) COENZYME A LITHIUM SALT | CID 16219611 |
| CAS No. | 108347-83-7 |
| PubChem CID | 16219611 |
Synthetic Route by SureRoute
2. ACXZEH912 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) but-2-enethioate
S-(2-(3-(4-((((((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) (E)-but-2-enethioate, lithium salt
Acryloyl-CoA