3-Oxo-7α-hydroxy-5β-cholanoic Acid (CAS 4185-00-6) — formula C24H38O4, molecular weight 390.6; category organic chemicals.
| CAS Number | 4185-00-6 |
|---|---|
| Molecular Formula | C24H38O4 |
| Molecular Weight | 390.6 |
| Melting Point | 88 - 90 °C |
| LogP | 4.5 |
| Category | Organic Chemicals |
3-Oxo-7α-hydroxy-5β-cholanoic Acid is a carbon-based organic compound with CAS registry number 4185-00-6 and molecular formula C24H38O4 (molecular weight 390.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 4185-00-6
Its molecular formula C24H38O4 comprises 24 C, 38 H, 4 O atoms.
Also known as: 3-Oxo-7α-hydroxy-5β-cholanoic Acid · 熊去氧胆酸EP杂质J（奥贝胆酸杂质17）
Category: organic chemicals
The CAS registry number of 3-Oxo-7α-hydroxy-5β-cholanoic Acid is 4185-00-6.
Molecular formula C24H38O4, molecular weight 390.6.
It is also registered under: 3-Oxo-7α-hydroxy-5β-cholanoic Acid, 熊去氧胆酸EP杂质J（奥贝胆酸杂质17）.
Category: Organic Chemicals.
Independent reference data for 3-Oxo-7α-hydroxy-5β-cholanoic Acid (CAS 4185-00-6), compiled from public chemistry databases.
| CAS 号 | 4185-00-6 |
|---|---|
| PubChem CID | 5283932 |
| 分子式 | C24H38O4 |
| IUPAC 名称 | (4R)-4-[(5R,7R,8R,9S,10S,13R,14S,17R)-7-hydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid |
| UNII（FDA） | 3MY7NM9XNW |
| Molecular Weight | 390.6 |
|---|---|
| XLogP3 | 4.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 390.27700969 |
| Monoisotopic Mass | 390.27700969 |
| Topological Polar Surface Area | 74.6 |
| Heavy Atom Count | 28 |
| Melting Point | 88 - 90 °C |
|---|
4185-00-6; 7alpha-Hydroxy-3-oxo-5beta-cholan-24-oic Acid; 3-oxochenodeoxycholic acid; (5beta,7alpha)-7-hydroxy-3-oxocholan-24-oic acid; 3MY7NM9XNW; Dehydrochenodeoxycholic acid; 3-Oxo-7alpha-hydroxycholan-24-oic acid; 3-dehydrochenodeoxycholic acid; Cholan-24-oic acid, 7-hydroxy-3-oxo-, (5beta,7alpha)-; CHEBI:88097; DTXSID601272325; 3-OXO-7.ALPHA.-HYDROXYCHOLAN-24-OIC ACID; 7.ALPHA.-HYDROXY-3-OXO-5.BETA.-CHOLAN-24-OIC ACID; (5.BETA.,7.ALPHA.)-7-HYDROXY-3-OXOCHOLAN-24-OIC ACID; CHOLAN-24-OIC ACID, 7-HYDROXY-3-OXO-, (5.BETA.,7.ALPHA.)-; RefChem:547080
| 已通报的危害声明 | H317 (100%), H319 (100%) |
|---|
熊去氧胆酸EP杂质J（奥贝胆酸杂质17） · CAS 4185-00-6 · C24H38O4. UNII 3MY7NM9XNW. Melting Point: 88 - 90 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 熊去氧胆酸EP杂质J（奥贝胆酸杂质17）