(2R,3S,4R,4Ar,6S,7R,8As)-7-Amino-6-{[(1R,2R,3S,4R,6S)-4-Amino-2,3,6-Trihydroxycyclohexyl]Oxy}-4-Hydroxy-3-(Methylamino)Octahydropyrano[3,2-B]Pyran-2-Yl α-D-Glucopyranoside
Properties
| Property | Value |
|---|---|
| Formula | C21H39N3O13 |
| IUPAC Name | (2r,3r,4s,5r,6r)-2-[[(2r,3s,4r,4as,6r,7r,8as)-7-amino-6-[(1r,2r,3s,4r,6s)-4-amino-2,3,6-trihydroxy-cyclohexoxy]-4-hydroxy-3-(methylamino)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-2-yl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol |
| Molecular Mass | 541.547 g·mol−1 |
| Heat of Formation | -2470.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.89 ± 1.08 D |
| Volume | 609.23 Å 3 |
| Surface Area | 468.9 Å 2 |
| HOMO Energy | -9.56 ± 0.55 eV |
| LUMO Energy | 1.06 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CANJCXYUUJPQSP-NVTJRCOPSA-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 |