3A,4B,7A-Trihydroxy-5B-Cholanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C24H40O5 |
| IUPAC Name | (4r)-4-[(3r,4r,5s,7r,8s,9s,10r,13r,14s,17r)-3,4,7-trihydroxy-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 |
| Molecular Mass | 408.571 g·mol−1 |
| Heat of Formation | -1245.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.61 ± 1.08 D |
| Volume | 517.98 Å 3 |
| Surface Area | 396.18 Å 2 |
| HOMO Energy | -9.77 ± 0.55 eV |
| LUMO Energy | 0.96 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AIHWGPJJINPTRP-QEMSSKERSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |