Introduction：Basic information about Hyodeoxycholic acid CAS 83-49-8, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Hyodeoxycholic acid Basic information
| Product Name: | Hyodeoxycholic acid |
| Synonyms: | 7-deoxyhyocholicacid;alpha-hyodeoxycholicacid;3α,6α-Dihydroxy-5β-cholanoic acid;Hyodeoxycholic;3à,6à-dihydroxy-5á-cholan-24-oic acid;3a,6a-Dihydroxy-5b-Cholan-24-Oic Acid;HYODEOXYCHOLIC ACID FREE ACID;HYODEOXYCHOLIC ACID 98% |
| CAS: | 83-49-8 |
| MF: | C24H40O4 |
| MW: | 392.58 |
| EINECS: | 201-483-2 |
| Product Categories: | Inhibitors;reference standards from Chinese medicinal herbs (TCM).;standardized herbal extract;Herb extract;Intermediates & Fine Chemicals;Isotope Labelled Compounds;Metabolites & Impurities;Pharmaceuticals;Steroids;Natural Plant Extract;chemical reagent;pharmaceutical intermediate;phytochemical |
| Mol File: | 83-49-8.mol |
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Hyodeoxycholic acid Chemical Properties
| Melting point | 200-201 °C (lit.) |
| alpha | D20 +8° (alc) |
| Boiling point | 437.26°C (rough estimate) |
| density | 0.9985 (rough estimate) |
| refractive index | 1.4460 (estimate) |
| storage temp. | Refrigerator |
| solubility | Solubility in methanol, very faint turbidity. Slightly soluble in alcohol, acetone, ether and very slightly soluble in chloroform. |
| pka | 4.76±0.10(Predicted) |
| form | Solid |
| color | White to Off-White |
| Water Solubility | 5.889mg/L(25 ºC) |
| Merck | 14,4857 |
| InChIKey | DGABKXLVXPYZII-SIBKNCMHSA-N |
| SMILES | C[C@]12CC[C@@H](O)C[C@@]1([H])[C@@H](O)C[C@@]1([H])[C@]3([H])CC[C@]([H])([C@H](C)CCC(=O)O)[C@@]3(C)CC[C@]21[H] |&1:1,4,7,9,12,14,18,20,27,31,r| |
| CAS DataBase Reference | 83-49-8(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 36/37/38-40 |
| Safety Statements | 26-36/37/39-36-22-37 |
| WGK Germany | 3 |
| RTECS | FZ2050000 |
| HS Code | 29181990 |
| Storage Class | 11 - Combustible Solids |
Hyodeoxycholic acid Usage And Synthesis
| Chemical Properties | White Solid |
| Uses | Protected β-Hyodeoxycholic Acid (H998105), a potential bile acid metabolite. |
| Uses | Labelled Hyodeoxycholic Acid. Unlabelled version is isolated from pig bile. Antitumor agent |
| Uses | It is isolated from pig bile. Antitumor agent |
| Uses | Labelled β-Hyodeoxycholic Acid |
| Definition | ChEBI: A member of the class of 5beta-cholanic acids that is (5beta)-cholan-24-oic acid substituted by alpha-hydroxy groups at positions 3 and 6. |
| General Description | Hyodeoxycholic acid is a naturally occurring secondary bile acid. It is produced by the gut flora in the small intestine. Hyodeoxycholic acid is obtained from chenodeoxycholic acid during enterohepatic circulation of bile in rats. |
| Purification Methods | Crystallise -hyodeoxycholic acid from EtOAc or Me2CO. The K salt separates in needles from an alcoholic solution of the acid when an equivalent of KOMe is added (see lithocholic acid). [Weiland & Gumlish Hoppe Seyler's Z Physiol Chem 215 18 1933, Windaus & Bohne Justus Liebigs Ann Chem 433 278 1923, Beilstein 10 III 1631.] |
Hyodeoxycholic acid Preparation Products And Raw materials
| Raw materials | Ethyl acetate-->Sodium sulfate-->Congo red paper-->Basic Orange 2-->Bilirubin-->Congo Red-->Sodium cholate |
