Account Coenzyme A, S-(9Z,12Z)-9,12-octadecadienoate, ammonium salt (1:3)
- Catalog No. :
- ACCNRD647
- CAS No. :
- 1246304-39-1
- Molecular Formula :
- C39H69N8O17P3S
- Molecular Weight :
- 1047.01
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) (9Z,12Z)-octadeca-9,12-dienethioate, ammonia salt
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Product Information
| Product Name | Coenzyme A, S-(9Z,12Z)-9,12-octadecadienoate, ammonium salt (1:3) |
|---|---|
| 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) (9Z,12Z)-octadeca-9,12-dienethioate, ammonia salt |
| MDL No. | MFCD30179721 |
| Molecular Formula | C39H69N8O17P3S |
| Molecular Weight | 1047.01 |
| SMILES | O[C@@H]1[C@H](OP(O)(O)=O)[C@@H](COP(O)(OP(O)(OCC(C)([C@H](C(NCCC(NCCSC(CCCCCCC/C=C\C/C=C\CCCCC)=O)=O)=O)O)C)=O)=O)O[C@]1(N2C=NC3=C(N)N=CN=C23)[H].N |
| InChI Key | RVLVTOOPASSKFF-LCVWCGHXSA-N |
| Synonym | (9Z,12Z-OCTADECADIENOYL) COENZYME A (AMMONIUM SALT);18:2 (N6) COENZYME A;18:2 (n6) Coenzyme A;(9Z,12Z-octadecadienoyl) CoenzyMe A (aMMoniuM salt) |
| CAS No. | 1246304-39-1 |
| PubChem CID | 145710100 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACCNRD647 Molecular Building Block Synthetic Route
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
9(Z),12(Z)-Octadecadienoyl coenzyme
Coenzyme A, S-[(5Z,8Z,11Z,14Z)-5,8,11,14-eicosatetraenoate], triammonium salt