(2S,3R)-3-{[(2S,3S,4R,5R,6S)-3-Acetamido-5-Hydroxy-6-(Hydroxymethyl)-4-{[(2R,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-Yl]Oxy}Tetrahydro-2H-Pyran-2-Yl]Oxy}-2-Aminobutanoic Acid
Properties
Property | Value |
---|---|
Formula | C18H32N2O13 |
IUPAC Name | (2s,3r)-3-[(2r,3r,4r,5r,6r)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-2-amino-butanoic acid |
Molecular Mass | 484.452 g·mol−1 |
Heat of Formation | -2436.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.91 ± 1.08 D |
Volume | 557.28 Å 3 |
Surface Area | 426.27 Å 2 |
HOMO Energy | -9.53 ± 0.55 eV |
LUMO Energy | 0.95 ± eV |
Point Group Symmetry | C1 |
InChIKey | VWNOCGQJSBAAFO-KPCFJFNASA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |