(5S,6S,7S)-6,13-Dihydroxy-1,2,3-Trimethoxy-6,7-Dimethyl-5,6,7,8-Tetrahydrobenzo[3',4']Cycloocta[1',2':4,5]Benzo[1,2-D][1,3]Dioxol-5-Yl (2E)-2-Methyl-2-Butenoate
Properties
Property | Value |
---|---|
Formula | C27H32O9 |
IUPAC Name | (5s,6s,7s)-6,13-dihydroxy-1,2,3-trimethoxy-6,7-dimethyl-5,6,7,8-tetrahydrobenzo[3',4']cycloocta[1',2':4,5]benzo[1,2-d][1,3]dioxol-5-yl (2e)-2-methyl-2-butenoate |
Molecular Mass | 500.538 g·mol−1 |
Heat of Formation | -1348.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.95 ± 1.08 D |
Volume | 583.68 Å 3 |
Surface Area | 421.79 Å 2 |
HOMO Energy | -8.42 ± 0.55 eV |
LUMO Energy | 0.08 ± eV |
Point Group Symmetry | C1 |
InChIKey | BYZKFKFGPLUFIH-QHWVUYPCSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |