Cholan-24-油酸,6-乙基-3-羟基-7-氧代-,(3α,5β,6α)-(CAS 915038-26-5):分子式 C26H42O4、分子量 418.6。
| CAS号 | 915038-26-5 |
|---|---|
| 分子式 | C26H42O4 |
| 分子量 | 418.6 |
| LogP | 5.6 |
Cholan-24-油酸,6-乙基-3-羟基-7-氧代-,(3α,5β,6α)- 是一种化工化合物,登记 CAS 号为 915038-26-5,分子式 C26H42O4(分子量 418.6)。
登记 CAS 号:915038-26-5
其分子式 C26H42O4 由 26 个碳、42 个氢、4 个氧 组成。
别名/同义词:Cholan-24-油酸,6-乙基-3-羟基-7-氧代-,(3α,5β,6α)- · Cholan-24-oic acid,6-ethyl-3-hydroxy-7-oxo-,(3α,5β,6α)-
Cholan-24-油酸,6-乙基-3-羟基-7-氧代-,(3α,5β,6α)- 的 CAS 登记号为 915038-26-5。
分子式 C26H42O4,分子量 418.6。
别名/同义词:Cholan-24-油酸,6-乙基-3-羟基-7-氧代-,(3α,5β,6α)-、Cholan-24-oic acid,6-ethyl-3-hydroxy-7-oxo-,(3α,5β,6α)-。
Cholan-24-油酸,6-乙基-3-羟基-7-氧代-,(3α,5β,6α)-(CAS 915038-26-5)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 915038-26-5 |
|---|---|
| PubChem CID | 67102585 |
| Molecular formula | C26H42O4 |
| IUPAC name | (4R)-4-[(3R,5S,6R,8S,9S,10S,13R,14S,17R)-6-ethyl-3-hydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid |
| UNII (FDA) | 5Q3EE9PB98 |
| Molecular Weight | 418.6 |
|---|---|
| XLogP3 | 5.6 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 418.30830982 |
| Monoisotopic Mass | 418.30830982 |
| Topological Polar Surface Area | 74.6 |
| Heavy Atom Count | 30 |
915038-26-5; (3alpha,5beta,6alpha)-6-Ethyl-3-hydroxy-7-oxocholan-24-oic acid; 5Q3EE9PB98; Obeticholic Acid Impurity I; UNII-5Q3EE9PB98; (3|A,5|A,6|A)-6-Ethyl-3-hydroxy-7-oxocholan-24-oic acid; 3alpha-hydroxy-6alpha-ethyl-7-keto-5beta-cholan-24-oic acid; 3|A-hydroxy-6-ethyl-7-keto-5|A-cholan-24-oic acid; 3alpha-hydroxy-6-ethyl-7-keto-5beta-cholan-24-oic acid; 3alpha-Hydroxy-6alpha-ethyl-7-keto-5beta-cholanic acid; 6alpha-Ethyl-3alpha-hydroxy-7-keto-5beta-cholan-24-oic acid; Cholan-24-oic acid, 6-ethyl-3-hydroxy-7-oxo-, (3alpha,5beta,6alpha)-; (3?,5?,6?)-6-Ethyl-3-hydroxy-7-oxo-cholan-24-oic Acid; SCHEMBL1634330; LHSZAKRHUYJKIU-CNFLPKCYSA-N; MFCD28411245
Cholan-24-oic acid,6-ethyl-3-hydroxy-7-oxo-,(3α,5β,6α)- · CAS 915038-26-5 · C26H42O4. UNII 5Q3EE9PB98.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: Cholan-24-oic acid,6-ethyl-3-hydroxy-7-oxo-,(3α,5β,6α)-