1-S-[(1E,3R)-3-Hydroxy-N-(Sulfooxy)-4-Pentenimidoyl]-1-Thio-β-D-Glucopyranosato
Properties
Property | Value |
---|---|
Formula | C11H19NO10S2 |
IUPAC Name | [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] (1e,3r)-3-hydroxy-n-sulfooxy-pent-4-enimidothioate |
Molecular Mass | 389.399 g·mol−1 |
Heat of Formation | -1615.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.26 ± 1.08 D |
Volume | 409.53 Å 3 |
Surface Area | 337.61 Å 2 |
HOMO Energy | -9.20 ± 0.55 eV |
LUMO Energy | 2.10 ± eV |
Point Group Symmetry | C1 |
InChIKey | MYHSVHWQEVDFQT-INZKYMGHSA-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 |