3-C-Amino-5-C-[3-Carboxy-4-(Carboxymethyl)-2-Oxo-3-Cyclohexen-1-Yl]Hexofuranose
Properties
Property | Value |
---|---|
Formula | C15H21NO11 |
IUPAC Name | (5r)-5-[(1r)-1-[(2r,3s,4s,5s)-3-amino-3,4,5-trihydroxy-tetrahydrofuran-2-yl]-1,2-dihydroxy-ethyl]-2-(carboxymethyl)-6-oxo-cyclohexene-1-carboxylic acid |
Molecular Mass | 391.327 g·mol−1 |
Heat of Formation | -2059.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.76 ± 1.08 D |
Volume | 414.02 Å 3 |
Surface Area | 343.89 Å 2 |
HOMO Energy | -10.13 ± 0.55 eV |
LUMO Energy | -1.41 ± eV |
Point Group Symmetry | C1 |
InChIKey | ZVHZQSYVVVWFKK-XWRKQMQBSA-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 |