Tetra-deoxycholic acid
4-(10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentan-1-ol
Also Known As: Cholan-24-ol|tetra-deoxycholic acid|5-BETA-CHOLAN-24-OL|(R)-1-(4-Cyanophenyl)ethylamine|4-(10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentan-1-ol
CAS: 3110-99-4
| Molecular Formula | C24H42O |
|---|---|
| Molecular Weight | 346.32358 g/mol |
| LogP | 8.2 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 346.32358 |
| Monoisotopic Mass | 346.32358 |
| Heavy Atoms | 25 |
| Complexity | 473.0 |
Chemical Identifiers
| CAS Number | 3110-99-4 |
|---|---|
| SMILES | CC(CCCO)C1CCC2C1(CCC3C2CCC4C3(CCCC4)C)C |
| InChIKey | ZWJSLCYDYKYAGX-UHFFFAOYSA-N |
Product Overview
Tetra-deoxycholic acid (CAS 3110-99-4), with molecular formula C24H42O and molecular weight 346.32358 g/mol. IUPAC: 4-(10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentan-1-ol.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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