19-Norkaur-16-En-18-Oic Acid, 15-Hydroxy-2-((2-O-(3-Methyl-1-Oxobutyl)-3,4-Di-O-Sulfo-β-D-Glucopyranosyl)Oxy)-, (2β,4Alpha,15Alpha)-
Properties
| Property | Value |
|---|---|
| Formula | C30H46O16S2 |
| IUPAC Name | (1s,4s,5r,7r,9s,10r,13s,15s)-15-hydroxy-7-[(2r,3r,4r,5r,6r)-6-(hydroxymethyl)-3-(3-methylbutanoyloxy)-4,5-disulfooxy-tetrahydropyran-2-yl]oxy-9-methyl-14-methylene-tetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid |
| Molecular Mass | 726.807 g·mol−1 |
| Heat of Formation | -3070.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.08 ± 1.08 D |
| Volume | 786.05 Å 3 |
| Surface Area | 560.67 Å 2 |
| HOMO Energy | -10.04 ± 0.55 eV |
| LUMO Energy | 2.67 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FYQXODZRNSCOTR-ANFZLNLLSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O |