Hyodeoxycholic acid (HDCA)
| Catalog Number | BL-M000470 |
| CAS Number | 83-49-8 |
| Description | Hyodeoxycholic acid is a secondary bile acid, one of the metabolic byproducts of intestinal bacteria. It is a TGR5 (GPCR19) agonist, with an EC50 of 31.6 μM in CHO cells. |
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| IUPAC Name | (4R)-4-[(3R,5R,6S,8S,9S,10R,13R,14S,17R)-3,6-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]pentanoic acid |
| Synonyms | Iodeoxycholic acid; 7-Deoxyhyocholic acid; 3α,6α-Dihydroxy-5β-cholan-24-oic acid; 5β-cholan-24-oic acid-3α,6α-Diol; α-Hyodeoxycholic acid; 3α,6α-Dihydroxy-5β-cholanic acid |
| Molecular Weight | 392.57 |
| Molecular Formula | C24H40O4 |
| Boiling Point | 547.1±25.0°C at 760 mmHg |
| Melting Point | 200-201°C |
| Purity | >98% |
| Density | 1.1±0.1 g/cm3 |
| Solubility | Soluble in DMSO (Slightly), Ethanol (Sparingly), Methanol (Slightly) |
| Appearance | White or Off-white Powder |
| Shelf Life | 1 Year |
| Storage | Store at 2-8°C, protect from light |
| Percent Composition | C 73.43%, H 10.27%, O 16.30% |
| Canonical SMILES | CC(CCC(=O)O)C1CCC2C1(CCC3C2CC(C4C3(CCC(C4)O)C)O)C |
| InChI | InChI=1S/C24H40O4/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16+,17-,18+,19+,20+,21+,23-,24-/m1/s1 |
| InChI Key | DGABKXLVXPYZII-SIBKNCMHSA-N |
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