S-[2-[3-[[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] (E)-hex-2-enethioate (CAS 10018-93-6) — formula C27H44N7O17P3S, molecular weight 863.7; category organic chemicals.
| CAS Number | 10018-93-6 |
|---|---|
| Molecular Formula | C27H44N7O17P3S |
| Molecular Weight | 863.7 |
| LogP | -3.8 |
| Category | Organic Chemicals |
S-[2-[3-[[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] (E)-hex-2-enethioate is a carbon-based organic compound with CAS registry number 10018-93-6 and molecular formula C27H44N7O17P3S (molecular weight 863.7), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 10018-93-6
Its molecular formula C27H44N7O17P3S comprises 27 C, 44 H, 7 N, 17 O, 3 P, 1 S atoms.
Also known as: S-[2-[3-[[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] (E)-hex-2-enethioate · 辅酶A杂质11
Category: organic chemicals
The CAS registry number of S-[2-[3-[[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] (E)-hex-2-enethioate is 10018-93-6.
Molecular formula C27H44N7O17P3S, molecular weight 863.7.
It is also registered under: S-[2-[3-[[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] (E)-hex-2-enethioate, 辅酶A杂质11.
Category: Organic Chemicals.
Independent reference data for S-[2-[3-[[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] (E)-hex-2-enethioate (CAS 10018-93-6), compiled from public chemistry databases.
| CAS 号 | 10018-93-6 |
|---|---|
| PubChem CID | 440612 |
| 分子式 | C27H44N7O17P3S |
| IUPAC 名称 | S-[2-[3-[[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] hex-2-enethioate |
| Molecular Weight | 863.7 |
|---|---|
| XLogP3 | -3.8 |
| Hydrogen Bond Donor Count | 9 |
| Hydrogen Bond Acceptor Count | 22 |
| Rotatable Bond Count | 23 |
| Exact Mass | 863.17272513 |
| Monoisotopic Mass | 863.17272513 |
| Topological Polar Surface Area | 389 |
| Heavy Atom Count | 55 |
CTK3J8617; DTXSID60331509; RefChem:1082316; DTXCID60282603
辅酶A杂质11 · CAS 10018-93-6 · C27H44N7O17P3S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 辅酶A杂质11