(5S,6S,7S)-6-Hydroxy-13,14-Dimethoxy-6,7-Dimethyl-5,6,7,8-Tetrahydro[1,3]Benzodioxolo[5',6':3,4]Cycloocta[1,2-F][1,3]Benzodioxol-5-Yl (2Z)-2-Methyl-2-Butenoate
Properties
Property | Value |
---|---|
Formula | C27H30O9 |
IUPAC Name | (5s,6s,7s)-6-hydroxy-13,14-dimethoxy-6,7-dimethyl-5,6,7,8-tetrahydro[1,3]benzodioxolo[5',6':3,4]cycloocta[1,2-f][1,3]benzodioxol-5-yl (2z)-2-methyl-2-butenoate |
Molecular Mass | 498.522 g·mol−1 |
Heat of Formation | -1265.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.73 ± 1.08 D |
Volume | 567.11 Å 3 |
Surface Area | 425.51 Å 2 |
HOMO Energy | -8.44 ± 0.55 eV |
LUMO Energy | 3.06 ± eV |
Point Group Symmetry | C1 |
InChIKey | KIOQRWNZGHZFHB-UFZBKZSQSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |