[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy-[(3R)-3-hydroxy-3-[2-[2-(2-hydroxypropanoylsulfanyl)ethylcarbamoyl]ethylcarbamoyl]-2,2-dimethyl-propoxy]phosphoryl]oxy-phosphoryl]oxymethyl]oxolan-3-yl]oxyphosphonic acid (CAS 1926-57-4) — formula C24H40N7O18P3S, molecular weight 839.6; category organic chemicals.
| CAS Number | 1926-57-4 |
|---|---|
| Molecular Formula | C24H40N7O18P3S |
| Molecular Weight | 839.6 |
| LogP | -5.9 |
| Category | Organic Chemicals |
[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy-[(3R)-3-hydroxy-3-[2-[2-(2-hydroxypropanoylsulfanyl)ethylcarbamoyl]ethylcarbamoyl]-2,2-dimethyl-propoxy]phosphoryl]oxy-phosphoryl]oxymethyl]oxolan-3-yl]oxyphosphonic acid is a carbon-based organic compound with CAS registry number 1926-57-4 and molecular formula C24H40N7O18P3S (molecular weight 839.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 1926-57-4
Its molecular formula C24H40N7O18P3S comprises 24 C, 40 H, 7 N, 18 O, 3 P, 1 S atoms.
Also known as: [(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy-[(3R)-3-hydroxy-3-[2-[2-(2-hydroxypropanoylsulfanyl)ethylcarbamoyl]ethylcarbamoyl]-2,2-dimethyl-propoxy]phosphoryl]oxy-phosphoryl]oxymethyl]oxolan-3-yl]oxyphosphonic acid · L-乳酰辅酶A
Category: organic chemicals
The CAS registry number of [(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy-[(3R)-3-hydroxy-3-[2-[2-(2-hydroxypropanoylsulfanyl)ethylcarbamoyl]ethylcarbamoyl]-2,2-dimethyl-propoxy]phosphoryl]oxy-phosphoryl]oxymethyl]oxolan-3-yl]oxyphosphonic acid is 1926-57-4.
Molecular formula C24H40N7O18P3S, molecular weight 839.6.
It is also registered under: [(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy-[(3R)-3-hydroxy-3-[2-[2-(2-hydroxypropanoylsulfanyl)ethylcarbamoyl]ethylcarbamoyl]-2,2-dimethyl-propoxy]phosphoryl]oxy-phosphoryl]oxymethyl]oxolan-3-yl]oxyphosphonic acid, L-乳酰辅酶A.
Category: Organic Chemicals.
Independent reference data for [(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy-[(3R)-3-hydroxy-3-[2-[2-(2-hydroxypropanoylsulfanyl)ethylcarbamoyl]ethylcarbamoyl]-2,2-dimethyl-propoxy]phosphoryl]oxy-phosphoryl]oxymethyl]oxolan-3-yl]oxyphosphonic acid (CAS 1926-57-4), compiled from public chemistry databases.
| CAS 号 | 1926-57-4 |
|---|---|
| PubChem CID | 3081970 |
| 分子式 | C24H40N7O18P3S |
| IUPAC 名称 | S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 2-hydroxypropanethioate |
| UNII（FDA） | NS00125988 |
| Molecular Weight | 839.6 |
|---|---|
| XLogP3 | -5.9 |
| Hydrogen Bond Donor Count | 10 |
| Hydrogen Bond Acceptor Count | 23 |
| Rotatable Bond Count | 21 |
| Exact Mass | 839.13633962 |
| Monoisotopic Mass | 839.13633962 |
| Topological Polar Surface Area | 409 |
| Heavy Atom Count | 53 |
Lactyl-coa; RefChem:1088333; Lactoyl-CoA; 1926-57-4; Lactoyl-coenzyme A; Coenzyme A, lactoyl-; Coenzyme A, S-(2-hydroxypropanoate); Lactyl Coenzyme A, Free acid; CoA 3:0;O; 2-hydroxypropanoyl CoA; 2-hydroxypropionyl CoA; S-(2-hydroxypropanoate; alpha-hydroxypropanoyl CoA; alpha-hydroxypropionyl CoA; S-(2-hydroxypropanoic acid; 2-hydroxypropanoyl coenzyme A
L-乳酰辅酶A · CAS 1926-57-4 · C24H40N7O18P3S. UNII NS00125988.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: L-乳酰辅酶A