3-Acetyldigoxigenin (CAS 80680-86-0) — formula C25H36O6, molecular weight 432.5; category organic chemicals.
| CAS Number | 80680-86-0 |
|---|---|
| Molecular Formula | C25H36O6 |
| Molecular Weight | 432.5 |
| LogP | 1.7 |
| Category | Organic Chemicals |
3-Acetyldigoxigenin is a carbon-based organic compound with CAS registry number 80680-86-0 and molecular formula C25H36O6 (molecular weight 432.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 80680-86-0
Its molecular formula C25H36O6 comprises 25 C, 36 H, 6 O atoms.
Also known as: 3-Acetyldigoxigenin · 3-乙酰地高辛
Category: organic chemicals
The CAS registry number of 3-Acetyldigoxigenin is 80680-86-0.
Molecular formula C25H36O6, molecular weight 432.5.
It is also registered under: 3-Acetyldigoxigenin, 3-乙酰地高辛.
Category: Organic Chemicals.
Independent reference data for 3-Acetyldigoxigenin (CAS 80680-86-0), compiled from public chemistry databases.
| CAS 号 | 80680-86-0 |
|---|---|
| PubChem CID | 54599 |
| 分子式 | C25H36O6 |
| IUPAC 名称 | [(3S,5R,10S,12R,13S,14S,17R)-12,14-dihydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate |
| Molecular Weight | 432.5 |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 432.25118886 |
| Monoisotopic Mass | 432.25118886 |
| Topological Polar Surface Area | 93.1 |
| Heavy Atom Count | 31 |
80680-86-0; 5-beta-CARD-20(22)-ENOLIDE, 3-beta,12-beta,14-TRIHYDROXY-, 3-ACETATE; RefChem:1072678; 3-Monoacetyldigoxigenin; 3-Acetyldigoxigenin; Digoxigenin-3-acetate; BRN 4724729; 3-beta,12-beta,14-Trihydroxy-5-beta-card-20(22)-enolide 3-acetate; Card-20(22)-enolide, 3-(acetyloxy)-3,14-dihydroxy-, (3-beta,5-beta,12-beta)-; DTXSID101001410; 3-(Acetyloxy)-12,14-dihydroxycard-20(22)-enolide; (8xi,9xi)-3beta-(Acetyloxy)-12beta,14-dihydroxy-5beta-card-20(22)-enolide
3-乙酰地高辛 · CAS 80680-86-0 · C25H36O6.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-乙酰地高辛