4-[Methyl(Nitroso)Amino]-1-(3-Pyridinyl)Butyl (5Xi)-β-D-Lyxo-Hexopyranosiduronic Acid
Properties
| Property | Value |
|---|---|
| Formula | C16H23N3O8 |
| IUPAC Name | (2s,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[(1s)-4-[methyl(nitroso)amino]-1-(3-pyridyl)butoxy]tetrahydropyran-2-carboxylic acid |
| Molecular Mass | 385.369 g·mol−1 |
| Heat of Formation | -1148.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.25 ± 1.08 D |
| Volume | 443.11 Å 3 |
| Surface Area | 386.49 Å 2 |
| HOMO Energy | -9.64 ± 0.55 eV |
| LUMO Energy | -0.65 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KNPUXTWHFSLCDT-SFYOKDCNSA-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 |