3-Hydroxy-3-Methyl-5-Oxo-5-[(3,12,24,25-Tetrahydroxylanost-8-En-2-Yl)Oxy]Pentanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C36H60O9 |
| IUPAC Name | (3s)-5-[[(2r,3r,5r,10s,12s,13r,14s,17r)-17-[(1r,4r)-4,5-dihydroxy-1,5-dimethyl-hexyl]-3,12-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1h-cyclopenta[a]phenanthren-2-yl]oxy]-3-hydroxy-3-methyl-5-oxo-pentanoic acid |
| Molecular Mass | 636.856 g·mol−1 |
| Heat of Formation | -2123.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.62 ± 1.08 D |
| Volume | 812.56 Å 3 |
| Surface Area | 589.13 Å 2 |
| HOMO Energy | -8.84 ± 0.55 eV |
| LUMO Energy | 0.49 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SWRXIGFQDQTNKP-WEYFBGBOSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |