Ethyl 3-O-{(6R)-5-Acetamido-3,5-Dideoxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]-β-L-Threo-Hex-2-Ulopyranonosyl}-1-Thio-β-D-Galactopyranoside
Properties
| Property | Value |
|---|---|
| Formula | C19H33NO13S |
| IUPAC Name | (2s,4s,5r,6r)-5-acetamido-2-[(2s,3r,4s,5s,6r)-2-ethylsulfanyl-3,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-4-yl]oxy-4-hydroxy-6-[(1r,2r)-1,2,3-trihydroxypropyl]tetrahydropyran-2-carboxylic acid |
| Molecular Mass | 515.529 g·mol−1 |
| Heat of Formation | -2468.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.85 ± 1.08 D |
| Volume | 571.75 Å 3 |
| Surface Area | 458.23 Å 2 |
| HOMO Energy | -9.07 ± 0.55 eV |
| LUMO Energy | 2.60 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XJSZEPMRURTGAF-DGRRIGLBSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |