methyl 3alpha-[(ethoxycarbonyl)oxy]-12alpha-hydroxy-7-oxo-5beta-cholan-24-oate (CAS 21059-40-5) — formula C28H44O7, molecular weight 492.6; category organic chemicals.
| CAS Number | 21059-40-5 |
|---|---|
| Molecular Formula | C28H44O7 |
| Molecular Weight | 492.6 |
| LogP | 5 |
| Category | Organic Chemicals |
methyl 3alpha-[(ethoxycarbonyl)oxy]-12alpha-hydroxy-7-oxo-5beta-cholan-24-oate is a carbon-based organic compound with CAS registry number 21059-40-5 and molecular formula C28H44O7 (molecular weight 492.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 21059-40-5
Its molecular formula C28H44O7 comprises 28 C, 44 H, 7 O atoms.
Also known as: methyl 3alpha-[(ethoxycarbonyl)oxy]-12alpha-hydroxy-7-oxo-5beta-cholan-24-oate · 3α-[(乙氧基羰基)氧基]-12α-羟基-7-氧代-5β-胆烷-24-酸甲酯
Category: organic chemicals
The CAS registry number of methyl 3alpha-[(ethoxycarbonyl)oxy]-12alpha-hydroxy-7-oxo-5beta-cholan-24-oate is 21059-40-5.
Molecular formula C28H44O7, molecular weight 492.6.
It is also registered under: methyl 3alpha-[(ethoxycarbonyl)oxy]-12alpha-hydroxy-7-oxo-5beta-cholan-24-oate, 3α-[(乙氧基羰基)氧基]-12α-羟基-7-氧代-5β-胆烷-24-酸甲酯.
Category: Organic Chemicals.
Independent reference data for methyl 3alpha-[(ethoxycarbonyl)oxy]-12alpha-hydroxy-7-oxo-5beta-cholan-24-oate (CAS 21059-40-5), compiled from public chemistry databases.
| CAS 号 | 21059-40-5 |
|---|---|
| PubChem CID | 89424 |
| 分子式 | C28H44O7 |
| IUPAC 名称 | methyl 4-(3-ethoxycarbonyloxy-12-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)pentanoate |
| Molecular Weight | 492.6 |
|---|---|
| XLogP3 | 5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 9 |
| Exact Mass | 492.30870374 |
| Monoisotopic Mass | 492.30870374 |
| Topological Polar Surface Area | 99.1 |
| Heavy Atom Count | 35 |
21059-40-5; methyl 3-[(ethoxycarbonyl)oxy]-12-hydroxy-7-oxocholan-24-oate; Methyl 3alpha-((ethoxycarbonyl)oxy)-12alpha-hydroxy-7-oxo-5beta-cholan-24-oate; DTXSID60943368; EINECS 244-183-7
3α-[(乙氧基羰基)氧基]-12α-羟基-7-氧代-5β-胆烷-24-酸甲酯 · CAS 21059-40-5 · C28H44O7.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.