(3β,5β,9β)-3-(Propionyloxy)Cholan-24-Oic Acid
Properties
| Property | Value |
|---|---|
| Formula | C27H44O4 |
| IUPAC Name | (4r)-4-[(3r,5r,8r,9s,10s,13r,14s,17r)-10,13-dimethyl-3-propanoyloxy-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 | 432.636 g·mol−1 |
| Heat of Formation | -1116.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.36 ± 1.08 D |
| Volume | 566.11 Å 3 |
| Surface Area | 451.55 Å 2 |
| HOMO Energy | -10.02 ± 0.55 eV |
| LUMO Energy | 3.98 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RDIKLWFVJHJCMN-RMXYKXGFSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |