(2R)-2-{[(Benzoylamino)Acetyl]Amino}-6-({[(2R,3S,4R,5R)-2,3,4,5-Tetrahydroxytetrahydro-2H-Pyran-2-Yl]Methyl}Amino)Hexanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C21H31N3O9 |
| IUPAC Name | (2r)-2-[(2-benzamidoacetyl)amino]-6-[[(2r,3s,4r,5r)-2,3,4,5-tetrahydroxytetrahydropyran-2-yl]methylamino]hexanoic acid |
| Molecular Mass | 469.486 g·mol−1 |
| Heat of Formation | -1666.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.12 ± 1.08 D |
| Volume | 550.55 Å 3 |
| Surface Area | 399.17 Å 2 |
| HOMO Energy | -9.45 ± 0.55 eV |
| LUMO Energy | -0.80 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DJDWCZDCENIWRI-PNUKLQRASA-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 |