2-(3,4-Dihydroxyphenyl)-7-(Hexopyranosyloxy)-5-Hydroxy-4-Oxo-4H-Chromen-3-Olate
Properties
Property | Value |
---|---|
Formula | C21H20O12 |
IUPAC Name | 2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-4-one |
Molecular Mass | 464.376 g·mol−1 |
Heat of Formation | -1874.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.51 ± 1.08 D |
Volume | 479.07 Å 3 |
Surface Area | 405.58 Å 2 |
HOMO Energy | -9.10 ± 0.55 eV |
LUMO Energy | -1.12 ± eV |
Point Group Symmetry | C1 |
InChIKey | BBFYUPYFXSSMNV-RONSJCHFSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |