(3β,4Alpha,9β,16β,22Xi)-4,12,14,16,17,20-Hexahydroxy-4,9-Epoxycevan-3-Yl (2Z)-2-Methyl-2-Butenoate
Properties
Property | Value |
---|---|
Formula | C32H49NO9 |
IUPAC Name | (3beta,4beta,5xi,8xi,9xi,10alpha,12beta,13xi,14beta,16alpha,17beta,20beta,22xi,25alpha)-4,12,14,16,17,20-hexahydroxy-4,9-epoxycevan-3-yl (2z)-2-methyl-2-butenoate |
Molecular Mass | 591.733 g·mol−1 |
Heat of Formation | -1869.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.86 ± 1.08 D |
Volume | 689.86 Å 3 |
Surface Area | 511.51 Å 2 |
HOMO Energy | -8.82 ± 0.55 eV |
LUMO Energy | 0.06 ± eV |
Point Group Symmetry | C1 |
InChIKey | DBUCFOVFALNEOO-ZDSUVPJUSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |