2-[3,4-Dihydroxy-5-(3-Methyl-2-Buten-1-Yl)Phenyl]-5-Hydroxy-3-(Hydroxymethyl)-4-Oxo-4H-Chromen-7-Yl 2-O-β-D-Glucopyranosyl-β-D-Glucopyranoside
Properties
Property | Value |
---|---|
Formula | C33H40O17 |
IUPAC Name | 7-[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-2-[3,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5-hydroxy-3-(hydroxymethyl)chromen-4-one |
Molecular Mass | 708.660 g·mol−1 |
Heat of Formation | -2855.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.25 ± 1.08 D |
Volume | 792.12 Å 3 |
Surface Area | 629.33 Å 2 |
HOMO Energy | -9.06 ± 0.55 eV |
LUMO Energy | -0.90 ± eV |
Point Group Symmetry | C1 |
InChIKey | ZDGISMQFYIDRSP-KZGGGLRYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |