[(2S,5R,6R,7R,10S,12R,13S)-5,13-Dihydroxy-6-(Hydroxymethyl)-2,6-Dimethyltetracyclo[10.3.1.0~1,10~.0~2,7~]Hexadec-13-Yl]Methyl Acetate
Properties
Property | Value |
---|---|
Formula | C22H36O5 |
IUPAC Name | [(5r,6r,7r,10s,12r,13s)-5,13-dihydroxy-6-(hydroxymethyl)-2,6-dimethyltetracyclo[10.3.1.0 1,10 .0 2,7 ]hexadec-13-yl]methyl acetate |
Molecular Mass | 380.518 g·mol−1 |
Heat of Formation | -1133.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.91 ± 1.08 D |
Volume | 467.18 Å 3 |
Surface Area | 353.13 Å 2 |
HOMO Energy | -9.88 ± 0.55 eV |
LUMO Energy | 1.10 ± eV |
Point Group Symmetry | C1 |
InChIKey | GAPINCSXTLCIPV-YZWRWILZSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |