(1R,19S,21R,22S,23S)-6,7,8,11,12,13,22,23-Octahydroxy-3,16-Dioxo-2,17,20-Trioxatetracyclo[17.3.1.0~4,9~.0~10,15~]Tricosa-4,6,8,10,12,14-Hexaen-21-Yl 3,4,5-Trihydroxybenzoate
Properties
| Property | Value |
|---|---|
| Formula | C27H22O18 |
| IUPAC Name | (1r,19s,21r,22s,23s)-6,7,8,11,12,13,22,23-octahydroxy-3,16-dioxo-2,17,20-trioxatetracyclo[17.3.1.0 4,9 .0 10,15 ]tricosa-4,6,8,10,12,14-hexaen-21-yl 3,4,5-trihydroxybenzoate |
| Molecular Mass | 634.453 g·mol−1 |
| Heat of Formation | -2850.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.90 ± 1.08 D |
| Volume | 637.97 Å 3 |
| Surface Area | 472.02 Å 2 |
| HOMO Energy | -9.09 ± 0.55 eV |
| LUMO Energy | -1.14 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | TUSDEZXZIZRFGC-VPIGZIKCSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |