(1R,2S,5S,6S)-1-[(1S,2E,4S,6E)-1,4-Dihydroxy-3,7,11-Trimethyl-2,6,10-Dodecatrien-1-Yl]-4-(Hydroxymethyl)-7-Oxabicyclo[4.1.0]Hept-3-Ene-2,5-Diol
Properties
Property | Value |
---|---|
Formula | C22H34O6 |
IUPAC Name | (1s,2s,5s,6r)-6-[(1s,2e,4s,6e)-1,4-dihydroxy-3,7,11-trimethyl-dodeca-2,6,10-trienyl]-3-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol |
Molecular Mass | 394.502 g·mol−1 |
Heat of Formation | -1013.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.21 ± 1.08 D |
Volume | 506.19 Å 3 |
Surface Area | 392.71 Å 2 |
HOMO Energy | -8.94 ± 0.55 eV |
LUMO Energy | -0.38 ± eV |
Point Group Symmetry | C1 |
InChIKey | VTOBGWHJIIZDHV-SDBCYGQVSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |