2-(3,4-Dihydroxyphenyl)Ethyl 2-O-[(2S,3R,4R)-3,4-Dihydroxy-4-(Hydroxymethyl)Tetrahydro-2-Furanyl]-4-O-[(2E)-3-(3,4-Dihydroxyphenyl)-2-Propenoyl]-β-D-Glucopyranoside
Properties
Property | Value |
---|---|
Formula | C28H34O15 |
IUPAC Name | [(2r,3s,4s,5r,6r)-5-[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]oxy-6-[2-(3,4-dihydroxyphenyl)ethoxy]-4-hydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl] (e)-3-(3,4-dihydroxyphenyl)prop-2-enoate |
Molecular Mass | 610.561 g·mol−1 |
Heat of Formation | -2480.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.01 ± 1.08 D |
Volume | 673.94 Å 3 |
Surface Area | 548.21 Å 2 |
HOMO Energy | -8.42 ± 0.55 eV |
LUMO Energy | -1.21 ± eV |
Point Group Symmetry | C1 |
InChIKey | MNAIMEPYDVJSJU-WLJWCVHXSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |