[(2S,3R,4R,5S,6R)-3-Acetamido-4,5-Dihydroxy-6-(Hydroxymethyl)Tetrahydrothiopyran-2-Yl] [[(2R,3S,4R,5R)-5-(2,4-Dioxopyrimidin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Oxido-Phosphoryl] Phosphate
Properties
Property | Value |
---|---|
Formula | C17H27N3O16P2S |
IUPAC Name | [(2s,3r,4r,5s,6r)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydrothiopyran-2-yl] [[(2r,3s,4r,5r)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] hydrogen phosphate |
Molecular Mass | 623.419 g·mol−1 |
Heat of Formation | -3522.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.24 ± 1.08 D |
Volume | 627.65 Å 3 |
Surface Area | 493.03 Å 2 |
HOMO Energy | -9.01 ± 0.55 eV |
LUMO Energy | -1.56 ± eV |
Point Group Symmetry | C1 |
InChIKey | JPRVHSQHWXZSNC-UBDZBXRQSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C H O N P S |