Methyl 2-{[6-O-(β-D-Xylofuranosyl)-β-D-Glucopyranosyl]Oxy}Benzoate
Properties
Property | Value |
---|---|
Formula | C19H26O12 |
IUPAC Name | methyl 2-[(2s,3r,4s,5s,6r)-6-[[(2r,3r,4r,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]oxymethyl]-3,4,5-trihydroxy-tetrahydropyran-2-yl]oxybenzoate |
Molecular Mass | 446.403 g·mol−1 |
Heat of Formation | -2054.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.08 ± 1.08 D |
Volume | 492.81 Å 3 |
Surface Area | 370.32 Å 2 |
HOMO Energy | -9.59 ± 0.55 eV |
LUMO Energy | -0.48 ± eV |
Point Group Symmetry | C1 |
InChIKey | XJOQBSUAJMEVGS-KFRLPSNLSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |