5-{(E)-2-[(2S,3R,4S)-2-(β-D-Glucopyranosyloxy)-5-(Methoxycarbonyl)-3-Vinyl-3,4-Dihydro-2H-Pyran-4-Yl]Vinyl}-1-(2-Hydroxyethyl)-3-Pyridiniumcarboxylate
Properties
Property | Value |
---|---|
Formula | C25H32NO12+ |
IUPAC Name | 1-(2-hydroxyethyl)-5-[(e)-2-[(2s,3r,4s)-5-methoxycarbonyl-2-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-3-vinyl-3,4-dihydro-2h-pyran-4-yl]vinyl]pyridin-1-ium-3-carboxylic acid |
Molecular Mass | 538.521 g·mol−1 |
Heat of Formation | -1906.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.50 ± 1.08 D |
Volume | 626.32 Å 3 |
Surface Area | 495.82 Å 2 |
Point Group Symmetry | C1 |
InChIKey | FPYKDTSNMCSLIB-ZHDNQQBJSA-O |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |