4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-te tradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid (CAS 2304-89-4) — formula C24H38O5, molecular weight 406.6; category organic chemicals.
| CAS Number | 2304-89-4 |
|---|---|
| Molecular Formula | C24H38O5 |
| Molecular Weight | 406.6 |
| Melting Point | 218 - 220 °C |
| LogP | 3.2 |
| Category | Organic Chemicals |
4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-te tradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid is a carbon-based organic compound with CAS registry number 2304-89-4 and molecular formula C24H38O5 (molecular weight 406.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 2304-89-4
Its molecular formula C24H38O5 comprises 24 C, 38 H, 5 O atoms.
Also known as: 4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-te tradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid · 胆酸杂质28
Category: organic chemicals
The CAS registry number of 4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-te tradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid is 2304-89-4.
Molecular formula C24H38O5, molecular weight 406.6.
It is also registered under: 4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-te tradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid, 胆酸杂质28.
Category: Organic Chemicals.
Independent reference data for 4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-te tradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid (CAS 2304-89-4), compiled from public chemistry databases.
| CAS 号 | 2304-89-4 |
|---|---|
| PubChem CID | 5283956 |
| 分子式 | C24H38O5 |
| IUPAC 名称 | (4R)-4-[(5R,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-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） | NFU5ZM6X6V |
| Molecular Weight | 406.6 |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 406.27192431 |
| Monoisotopic Mass | 406.27192431 |
| Topological Polar Surface Area | 94.8 |
| Heavy Atom Count | 29 |
| Melting Point | 218 - 220 °C |
|---|
3-Oxocholic acid; 2304-89-4; 7,12-Dihydroxy-3-oxocholanic acid; DTXSID801316583; 3-oxo-7alpha,12alpha-dihydroxy-5beta-cholan-24-oic acid; Cholan-24-oic acid, 7,12-dihydroxy-3-oxo-, (5beta,7alpha,12alpha)-; RefChem:95236; DTXCID701746422; 3-Oxo-7a,12a-dihydroxy-5b-cholanic acid; 3-?Oxocholic acid; 3-Ketocholic acid; 7alpha,12alpha-Dihydroxy-3-oxo-5beta-cholan-24-oic Acid; 7alpha,12alpha-Dihydroxy-3-oxo-cholanoic acid; 3-dehydrocholic acid; NFU5ZM6X6V; 3-Oxocholate
| 已通报的危害声明 | H319 (100%) |
|---|
胆酸杂质28 · CAS 2304-89-4 · C24H38O5. UNII NFU5ZM6X6V. Melting Point: 218 - 220 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 胆酸杂质28