(1R,5R,6S,13S,21R)-13-(4-Hydroxyphenyl)-5-(3,4,5-Trihydroxyphenyl)-4,12,14-Trioxapentacyclo[11.7.1.0~2,11~.0~3,8~.0~15,20~]Henicosa-2,8,10,15,17,19-Hexaene-6,9,17,19,21-Pentol
Properties
| Property | Value |
|---|---|
| Formula | C30H24O12 |
| IUPAC Name | (1r,5r,6s,13s,21r)-13-(4-hydroxyphenyl)-5-(3,4,5-trihydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0 2,11 .0 3,8 .0 15,20 ]henicosa-2,8,10,15,17,19-hexaene-6,9,17,19,21-pentol |
| Molecular Mass | 576.504 g·mol−1 |
| Heat of Formation | -1798.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.34 ± 1.08 D |
| Volume | 601.47 Å 3 |
| Surface Area | 481.3 Å 2 |
| HOMO Energy | -8.95 ± 0.55 eV |
| LUMO Energy | 2.73 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DWIOQBZYELAYFO-AMEQXESTSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |