(2S)-2-Amino-4-({[(2S,4R,5R)-5-(4-Amino-1H-Imidazo[4,5-C]Pyridin-1-Yl)-4-Hydroxytetrahydro-2-Furanyl]Methyl}Sulfanyl)Butanoic Acid
Properties
Property | Value |
---|---|
Formula | C15H21N5O4S |
IUPAC Name | (2s)-2-amino-4-[[(2r,4r,5r)-5-(4-aminoimidazo[4,5-c]pyridin-1-ium-1-yl)-4-hydroxy-tetrahydrofuran-2-yl]methylsulfanyl]butanoic acid |
Molecular Mass | 367.423 g·mol−1 |
Heat of Formation | -552.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.90 ± 1.08 D |
Volume | 418.08 Å 3 |
Surface Area | 340.46 Å 2 |
HOMO Energy | -8.41 ± 0.55 eV |
LUMO Energy | -0.15 ± eV |
Point Group Symmetry | C1 |
InChIKey | QJGGZPIWCXHXGB-SZRLZVLASA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |