(3R,5S,8S,9S,10S,13R,14S,17S)-17-乙酰基-3-羟基-10,13-二甲基-1,2,3,4,5,6,7,8,9,12,14,15,16,17-十四氢环五[a]菲-11-一: [2-[(3R,5S,8S,9S,10S,13R,14S,17S)-3-羟基-10,13-二甲基-11-氧代-1,2,3,4,5,6,7,8,9,12,14,15,16,17-十四氢环戊[a]菲烯-17-基]-2-氧代-乙基]乙酸酯(CAS 8067-82-1):分子式 C44H66O8、分子量 723.0。
| CAS号 | 8067-82-1 |
|---|---|
| 分子式 | C44H66O8 |
| 分子量 | 723.0 |
(3R,5S,8S,9S,10S,13R,14S,17S)-17-乙酰基-3-羟基-10,13-二甲基-1,2,3,4,5,6,7,8,9,12,14,15,16,17-十四氢环五[a]菲-11-一: [2-[(3R,5S,8S,9S,10S,13R,14S,17S)-3-羟基-10,13-二甲基-11-氧代-1,2,3,4,5,6,7,8,9,12,14,15,16,17-十四氢环戊[a]菲烯-17-基]-2-氧代-乙基]乙酸酯 是一种化工化合物,登记 CAS 号为 8067-82-1,分子式 C44H66O8(分子量 723.0)。
登记 CAS 号:8067-82-1
其分子式 C44H66O8 由 44 个碳、66 个氢、8 个氧 组成。
别名/同义词:(3R,5S,8S,9S,10S,13R,14S,17S)-17-乙酰基-3-羟基-10,13-二甲基-1,2,3,4,5,6,7,8,9,12,14,15,16,17-十四氢环五[a]菲-11-一: [2-[(3R,5S,8S,9S,10S,13R,14S,17S)-3-羟基-10,13-二甲基-11-氧代-1,2,3,4,5,6,7,8,9,12,14,15,16,17-十四氢环戊[a]菲烯-17-基]-2-氧代-乙基]乙酸酯 · (3R,5S,8S,9S,10S,13R,14S,17S)-17-acetyl-3-hydroxy-10,13-dimethyl-1,2,3 ,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11- one: [2-[(3R,5S,8S,9S,10S,13R,14S,17S)-3-hydroxy-10,13-dimethyl-11-oxo -1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthr en-17-yl]-2-oxo-ethyl] acetate
(3R,5S,8S,9S,10S,13R,14S,17S)-17-乙酰基-3-羟基-10,13-二甲基-1,2,3,4,5,6,7,8,9,12,14,15,16,17-十四氢环五[a]菲-11-一: [2-[(3R,5S,8S,9S,10S,13R,14S,17S)-3-羟基-10,13-二甲基-11-氧代-1,2,3,4,5,6,7,8,9,12,14,15,16,17-十四氢环戊[a]菲烯-17-基]-2-氧代-乙基]乙酸酯 的 CAS 登记号为 8067-82-1。
分子式 C44H66O8,分子量 723.0。
别名/同义词:(3R,5S,8S,9S,10S,13R,14S,17S)-17-乙酰基-3-羟基-10,13-二甲基-1,2,3,4,5,6,7,8,9,12,14,15,16,17-十四氢环五[a]菲-11-一: [2-[(3R,5S,8S,9S,10S,13R,14S,17S)-3-羟基-10,13-二甲基-11-氧代-1,2,3,4,5,6,7,8,9,12,14,15,16,17-十四氢环戊[a]菲烯-17-基]-2-氧代-乙基]乙酸酯、(3R,5S,8S,9S,10S,13R,14S,17S)-17-acetyl-3-hydroxy-10,13-dimethyl-1,2,3 ,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11- one: [2-[(3R,5S,8S,9S,10S,13R,14S,17S)-3-hydroxy-10,13-dimethyl-11-oxo -1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthr en-17-yl]-2-oxo-ethyl] acetate。
(3R,5S,8S,9S,10S,13R,14S,17S)-17-乙酰基-3-羟基-10,13-二甲基-1,2,3,4,5,6,7,8,9,12,14,15,16,17-十四氢环五[a]菲-11-一: [2-[(3R,5S,8S,9S,10S,13R,14S,17S)-3-羟基-10,13-二甲基-11-氧代-1,2,3,4,5,6,7,8,9,12,14,15,16,17-十四氢环戊[a]菲烯-17-基]-2-氧代-乙基]乙酸酯(CAS 8067-82-1)的独立参考数据,整理自公开化学数据库。
| CAS 号 | 8067-82-1 |
|---|---|
| PubChem CID | 24732 |
| 分子式 | C44H66O8 |
| Molecular Weight | 723.0 |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 722.47576906 |
| Monoisotopic Mass | 722.47576906 |
| Topological Polar Surface Area | 135 |
| Heavy Atom Count | 52 |
Saffan; 8067-82-1; RefChem:388780; Alfathesin; Alphadione; Alfatesine; Aurantex; ALTHESIN; Alfatesine [French]; CT-1341; DTXSID001001405; alfaxolone/alfadolone; SCHEMBL29722811; Q4721889; 3-Hydroxy-11,20-dioxopregnan-21-yl acetate--3-hydroxypregnane-11,20-dione (1/1); 3alpha-Hydroxy-11,20-dioxo-5alpha-pregnan-21-yl acetate--3alpha-hydroxy-5alpha-pregnane-11,20-dione (1/1)
(3R,5S,8S,9S,10S,13R,14S,17S)-17-乙酰基-3-羟基-10,13-二甲基-1,2,3,4,5,6,7,8,9,12,14,15,16,17-十四氢环五[a]菲-11-一: [2-[(3R,5S,8S,9S,10S,13R,14S,17S)-3-羟基-10,13-二甲基-11-氧代-1,2,3,4,5,6,7,8,9,12,14,15,16,17-十四氢环戊[a]菲烯-17-基]-2-氧代-乙基]乙酸酯 · CAS 8067-82-1 · C44H66O8.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。