5beta-Cholanic acid
- CAS No.
- 546-18-9
- Chemical Name:
- 5beta-Cholanic acid
- Synonyms
- URSOCHOLANIC ACID;3-Oxo-5βCholanoic Acid;5β-cholanicaci;5β-Cholanic acid;3,12-Diketo-5β5(H)-Cholanic acid;5beta-Cholanic acid;Cholan-24-oic acid, (5β)-;5-beta-cholan-24-oic acid
- CBNumber:
- CB7477878
- Molecular Formula:
- C24H40O2
- Molecular Weight:
- 360.57
- MDL Number:
- MFCD00065904
- MOL File:
- 546-18-9.mol
- MSDS File:
- SDS
- TDS File:
- TDS
| Melting point | 150 °C |
|---|---|
| Boiling point | 473.6±13.0 °C(Predicted) |
| Density | 1.018±0.06 g/cm3(Predicted) |
| storage temp. | Room Temperature |
| solubility | Chloroform (Slightly), Methanol (Slightly, Heated, Sonicated) |
| form | Solid |
| pka | 4.76±0.10(Predicted) |
| color | White to Off-White |
| InChI | 1S/C24H40O2/c1-16(7-12-22(25)26)19-10-11-20-18-9-8-17-6-4-5-14-23(17,2)21(18)13-15-24(19,20)3/h16-21H,4-15H2,1-3H3,(H,25,26) |
| InChIKey | RPKLZQLYODPWTM-ZPEDRQGKNA-N |
| SMILES | [C@]12(C)CC[C@]3([H])[C@@]4(C)CCCC[C@@]4([H])CC[C@@]3([H])[C@]1([H])CC[C@@H]2[C@H](C)CCC(=O)O |&1:0,4,6,12,16,18,22,23,r| |
| FDA UNII | 970EKW2JTO |
| UNSPSC Code | 12352106 |
| NACRES | NA.77 |
SAFETY
Risk and Safety Statements
| PPE | Eyeshields, Gloves, type N95 (US) |
|---|---|
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |
5beta-Cholanic acid price More Price(28)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| Sigma-Aldrich | C7628 | 5β-Cholanic acid ≥99% (TLC) | 546-18-9 | 1g | $325 | 2023-06-20 | Buy |
| Sigma-Aldrich | C7628 | 5β-Cholanic acid ≥99% (TLC) | 546-18-9 | 5g | $1370 | 2023-06-20 | Buy |
| Usbiological | 444462 | Cholanoic Acid | 546-18-9 | 5mg | $305 | 2026-06-03 | Buy |
| Usbiological | 444462 | Cholanoic Acid | 546-18-9 | 10mg | $425 | 2026-06-03 | Buy |
| TRC | TRC-C431430-5MG | Cholanoic Acid | 546-18-9 | 5mg | $64 | 2026-06-03 | Buy |
5beta-Cholanic acid Chemical Properties, Uses, Production
Uses
Cholanoic Acid is an impurity of Ursodeoxycholic Acid (U850000), which is used as an anticholelithogenic.
Definition
ChEBI: 5beta-cholanic acid is a cholanic acid and a member of 5beta-cholanic acids.
Purification Methods
Crystallise 5-cholanic acid from EtOH, Me2CO or AcOH. The ethyl ester has m 93-94o (from 80% EtOH), b 273o/12mm, [] D 20 +21o (CHCl3), and the methyl ester has m 86-87o (from MeOH) after purification through Al2O3 and eluting with *C6H6, and [] D 20 +21.2o (CHCl3). The 1H NMR (CDCl3) for the C18 & C19 protons has at 0.65 and 0.92ppm [see 5-cholanic acid above, Mandava et al. Steroids 23 357 1974]. [Stoll et al. Helv Chim Acta 18 644 1935, Huang-Minlon J Am Chem Soc 7 1 330 1949, Beilstein 9 III 2656, 9 IV 1992.]
5beta-Cholanic acid Preparation Products And Raw materials
Raw materials
Preparation Products
5beta-Cholanic acid Suppliers
| Supplier | Tel | Country | ProdList | Advantage | |
|---|---|---|---|---|---|
| Shanghai Rechem science Co., Ltd. | 021-31433387 15618786686 | sales@rechemscience.com | China | 2969 | 58 |
| Spectrum Chemical Manufacturing Corp. | 021-021-021-67601398-809-809-809 15221380277 | marketing_china@spectrumchemical.com | China | 9643 | 60 |
| Quality Control Solutions Ltd. | 0755-66853366 13670046396 | orders@qcsrm.com | China | 18188 | 56 |
| Shanghai Macklin Biochemical Co.,Ltd. | 15221275939 15221275939 | shenlinxing@macklin.cn | China | 15775 | 55 |
| Sigma-Aldrich | 021-61415566 800-8193336 | orderCN@merckgroup.com | China | 51389 | 80 |
| BOC Sciences | 16314854226 | info@bocsci.com | United States | 9909 | 65 |
| Shanghai YuanYe Biotechnology Co., Ltd. | 15026964105 | 2881489226@qq.com | China | 89667 | 60 |
| TOSUN PHARM | 020-66392521-118 18922260391 | 3004261881@qq.com | China | 7994 | 58 |
| BOC Sciences | 16314854226; +8616314854226 | inquiry@bocsci.com | United States | 19852 | 58 |
| Shaanxi Dideu Medichem Co. Ltd | +86-29-87569266 +86-17392581500 | 1015@dideu.com | China | 3861 | 58 |
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