Account S-Malonyl-CoA
- Catalog No. :
- ACOPAF803
- CAS No. :
- 524-14-1
- Molecular Formula :
- C24H38N7O19P3S
- Molecular Weight :
- 853.59
IUPAC Name:3-((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)thio)-3-oxopropanoic acid
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Product Information
| Product Name | S-Malonyl-CoA |
|---|---|
| IUPAC Name | 3-((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)thio)-3-oxopropanoic acid |
| Molecular Formula | C24H38N7O19P3S |
| Molecular Weight | 853.59 |
| SMILES | O=C(O)CC(SCCNC(CCNC([C@H](O)C(C)(C)COP(O)(OP(O)(OC[C@H]1O[C@@H](N2C=NC3=C(N)N=CN=C23)[C@H](O)[C@@H]1OP(O)(O)=O)=O)=O)=O)=O)=O |
| InChI Key | LTYOQGRJFJAKNA-DVVLENMVSA-N |
| Synonym | Malonyl Coenzyme A;coenzyme A malonyl derivative, tetralithium salt;Adenosine 5'-[diphosphoric acid β-[(R)-4-[[2-[[2-(carboxyacetylthio)ethyl]carbamoyl]ethyl]amino]-4-oxo-3-hydroxy-2,2-dimethylbutyl]]3'-phosphoric acid;S-(Carboxyacetyl)coenzyme A;malony-coa;S-(hydrogen malonyl)coenzyme A;Coenzyme A, S-(hydrogen propanedioate);3-[2-[3-[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]aminopropanoylamino]ethylsulfanyl]-3-oxo-propanoic acid |
| CAS No. | 524-14-1 |
Safety Data
- Pictogram
- Signal Word
- Warning
- 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. ACOPAF803 Molecular Building Block Synthetic Route
Coenzyme A, S-(hydrogen propanedioate), xlithium salt
Lithium (2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-(((((((R)-4-((3-((2-((2-carboxyacetyl)thio)ethyl)amino)-3-oxopropyl)amino)-3-hydroxy-2,2-dimethyl-4-oxobutoxy)oxidophosphoryl)oxy)oxidophosphoryl)oxy)methyl)-4-hydroxytetrahydrofuran-3-yl phosphate
Propionyl coenzyme A