Chemical Property of Dehydrolithocholic acid
Chemical Property:
- Vapor Pressure:0mmHg at 25°C
- Melting Point:140-141 °C
- Refractive Index:1.52
- Boiling Point:509.3 °C at 760 mmHg
- PKA:4.76±0.10(Predicted)
- Flash Point:275.9 °C
- PSA：54.37000
- Density:1.069 g/cm3
- LogP:5.71530
- Storage Temp.:Refrigerator
- Solubility.:Chloroform (Slightly), Methanol (Slightly)
- XLogP3:5.8
- Hydrogen Bond Donor Count:1
- Hydrogen Bond Acceptor Count:3
- Rotatable Bond Count:4
- Exact Mass:374.28209507
- Heavy Atom Count:27
- Complexity:613
- Purity/Quality:
-
97% *data from raw suppliers
3-Oxo-5β-cholanoic Acid *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
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SDS file from LookChem
Useful:
- Canonical SMILES:CC(CCC(=O)O)C1CCC2C1(CCC3C2CCC4C3(CCC(=O)C4)C)C
- Isomeric SMILES:C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CCC(=O)C4)C)C
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Uses
3-Oxo-5beta-cholanoic Acid is a steroid compound with pharmacological activity. It is a bile acid. Also used in the preparation of lithocholic acid derivatives used as proteasome regulators. 3-Oxo-5β-cholanoic Acid is a steroid compound with pharmacological activity. It is a bile acid. Also used in the preparation of lithocholic acid derivatives used as proteasome regulators.
