(1Ar,1Bs,4Ar,7As,7Br,8R,9As)-3-[(β-D-Glucopyranosyloxy)Methyl]-4A,7B-Dihydroxy-1,1,6,8-Tetramethyl-5-Oxo-1,1A,1B,4,4A,5,7A,7B,8,9-Decahydro-9Ah-Cyclopropa[3,4]Benzo[1,2-E]Azulen-9A-Yl Acetate
Properties
| Property | Value |
|---|---|
| Formula | C28H40O11 |
| IUPAC Name | (1ar,1bs,4ar,7as,7br,8r,9as)-3-[(beta-d-glucopyranosyloxy)methyl]-4a,7b-dihydroxy-1,1,6,8-tetramethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9ah-cyclopropa[3,4]benzo[1,2-e]azulen-9a-yl acetate |
| Molecular Mass | 552.611 g·mol−1 |
| Heat of Formation | -1889.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.16 ± 1.08 D |
| Volume | 651.25 Å 3 |
| Surface Area | 513.53 Å 2 |
| HOMO Energy | -9.55 ± 0.55 eV |
| LUMO Energy | -0.24 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JMDGBSYRPFFZBO-WHDWRCRCSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |