sodium 3-α,12-α-dihydroxy-5-β-cholan-24-oate (CAS 302-95-4) — formula C24H39NaO4, molecular weight 414.6; category inorganic chemicals.
| CAS Number | 302-95-4 |
|---|---|
| Molecular Formula | C24H39NaO4 |
| Molecular Weight | 414.6 |
| Category | Inorganic Chemicals |
sodium 3-α,12-α-dihydroxy-5-β-cholan-24-oate is an inorganic compound with CAS registry number 302-95-4 and molecular formula C24H39NaO4 (molecular weight 414.6), belonging to the inorganic chemicals segment of chemical raw materials.
CAS number: 302-95-4
Its molecular formula C24H39NaO4 comprises 24 C, 39 H, 1 Na, 4 O atoms.
Also known as: sodium 3-α,12-α-dihydroxy-5-β-cholan-24-oate · 3-α,12-α-二羟基-5-β-胆烷-24-燕麦酸钠
Category: inorganic chemicals
The CAS registry number of sodium 3-α,12-α-dihydroxy-5-β-cholan-24-oate is 302-95-4.
Molecular formula C24H39NaO4, molecular weight 414.6.
It is also registered under: sodium 3-α,12-α-dihydroxy-5-β-cholan-24-oate, 3-α,12-α-二羟基-5-β-胆烷-24-燕麦酸钠.
Category: Inorganic Chemicals.
Independent reference data for sodium 3-α,12-α-dihydroxy-5-β-cholan-24-oate (CAS 302-95-4), compiled from public chemistry databases.
| CAS Registry Number | 302-95-4 |
|---|---|
| PubChem CID | 23668196 |
| Molecular formula | C24H39NaO4 |
| IUPAC name | sodium (4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate |
| UNII (FDA) | 436LS6U35Y |
| Molecular Weight | 414.6 |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 414.27460400 |
| Monoisotopic Mass | 414.27460400 |
| Topological Polar Surface Area | 80.6 |
| Heavy Atom Count | 29 |
Sodium deoxycholate; 302-95-4; Deoxycholic acid sodium salt; Sodium desoxycholate; Deoxycholate sodium; Desoxycholate sodium; Sodium 7-deoxycholate; Na-Desoxycholat; Na-Desoxycholat [German]; CCRIS 655; DTXSID5033389; EINECS 206-132-7; UNII-436LS6U35Y; Dihydroxy 3-12 cholanate de Na [French]; ATX 101; Dihydroxy 3-12 cholanate de Na
| GHS notification summary | 33.3% (37 / 111) |
|---|
| GHS notification summary | 33.3% (37 / 111) |
|---|---|
| Reported hazard statements | H302 (66.7%), H335 (54.1%) |
This chemical does not meet GHS hazard criteria for 33.3% (37 of 111) of reports.
H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]
sodium 3-α,12-α-dihydroxy-5-β-cholan-24-oate · CAS 302-95-4 · C24H39NaO4. UNII 436LS6U35Y.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.