(2R)-2-{[(1R,2S,3R,4R,5R)-4-Acetamido-2-{[(2S,3R,4R,5S,6R)-3-Acetamido-4,5-Dihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-Yl]Oxy}-6,8-Dioxabicyclo[3.2.1]Oct-3-Yl]Oxy}Propanoic Acid (Non-Preferred Na Me)
Properties
Property | Value |
---|---|
Formula | C19H30N2O12 |
IUPAC Name | (2r)-2-[[(1r,2s,3r,4r,5r)-4-acetamido-2-[(2s,3r,4r,5s,6r)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-6,8-dioxabicyclo[3.2.1]octan-3-yl]oxy]propanoic acid |
Molecular Mass | 478.448 g·mol−1 |
Heat of Formation | -2210.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.71 ± 1.08 D |
Volume | 534.43 Å 3 |
Surface Area | 406.89 Å 2 |
HOMO Energy | -9.05 ± 0.55 eV |
LUMO Energy | 0.80 ± eV |
Point Group Symmetry | C1 |
InChIKey | MWWQKONGFKUAEK-STFZFCBQSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |