(10E)-6-{[5-Hydroxy-2-(Methoxymethyl)-9-Methyl-9-(2-Oxiranyl)-3,7,10,11-Tetraoxatricyclo[6.2.1.0~1,6~]Undec-4-Yl]Oxy}-7-Isopropyl-1-(Methoxymethyl)-4,9A-Dimethyl-1,2,3,3A,4,5,6,8,9,9A-Decahydrodicyclopenta[A,D][8]Annulene-1,5-Diol
Properties
| Property | Value |
|---|---|
| Formula | C33H50O11 |
| IUPAC Name | (1r,3as,4r,5r,6r,9ar,10e)-6-({(1s,2r,4s,5r,6r,8s,9s)-5-hydroxy-2-(methoxymethyl)-9-methyl-9-[(2s)-2-oxiranyl]-3,7,10,11-tetraoxatricyclo[6.2.1.0 1,6 ]undec-4-yl}oxy)-7-isopropyl-1-(methoxymethyl)-4,9a-dimethyl-1,2,3,3a,4,5,6,8,9,9a-decahydrodicyclopenta[a,d][8]annulene-1,5-diol (non-preferred name) |
| Molecular Mass | 622.743 g·mol−1 |
| Heat of Formation | -1802.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.05 ± 1.08 D |
| Volume | 734.18 Å 3 |
| Surface Area | 486.72 Å 2 |
| HOMO Energy | -9.00 ± 0.55 eV |
| LUMO Energy | 0.82 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SMQRKTIIIYTOTN-XWJJHAMOSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |