5β-孕烷-3α,17α,20α-三醇（CAS 1098-45-9）：分子式 C21H36O3、分子量 336.5。
| CAS号 | 1098-45-9 |
|---|---|
| 分子式 | C21H36O3 |
| 分子量 | 336.5 |
| LogP | 3.8 |
5β-孕烷-3α,17α,20α-三醇 是一种化工化合物，登记 CAS 号为 1098-45-9，分子式 C21H36O3（分子量 336.5）。
登记 CAS 号：1098-45-9
其分子式 C21H36O3 由 21 个碳、36 个氢、3 个氧 组成。
别名/同义词：5β-孕烷-3α,17α,20α-三醇 · 5beta-pregnane-3alpha,17alpha,20alpha-triol
5β-孕烷-3α,17α,20α-三醇 的 CAS 登记号为 1098-45-9。
分子式 C21H36O3，分子量 336.5。
别名/同义词：5β-孕烷-3α,17α,20α-三醇、5beta-pregnane-3alpha,17alpha,20alpha-triol。
5β-孕烷-3α,17α,20α-三醇（CAS 1098-45-9）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 1098-45-9 |
|---|---|
| PubChem CID | 101967 |
| Molecular formula | C21H36O3 |
| IUPAC name | (3R,5R,8R,9S,10S,13S,14S,17R)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol |
| UNII (FDA) | 43822S61TB |
| Molecular Weight | 336.5 |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 336.26644501 |
| Monoisotopic Mass | 336.26644501 |
| Topological Polar Surface Area | 60.7 |
| Heavy Atom Count | 24 |
PREGNANETRIOL; 1098-45-9; 5Beta-pregnane-3alpha,17alpha,20alpha-triol; NSC-52760; 43822S61TB; DTXSID00911364; Pregnane-3,17,20-triol, (3alpha,5beta,20S)-; 5-beta-Pregnane-3,17,20-triol; RefChem:175847; DTXCID601340401; 214-148-0; PREGNANTRIOL; Pregnane-3,17,20-triol, (3.alpha.,5.beta.,20S)-; 5-beta-Pregnane-3-alpha,17-alpha,20-alpha-triol; 5.beta.-pregnane-3.alpha.,17.alpha.,20.alpha.-triol; UNII-43822S61TB
| Reported hazard statements | H302 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
5beta-pregnane-3alpha,17alpha,20alpha-triol · CAS 1098-45-9 · C21H36O3. UNII 43822S61TB.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: 5beta-pregnane-3alpha,17alpha,20alpha-triol