1-O-(2-Aminobenzoyl)-β-D-Glucopyranuronic Acid
Properties
Property | Value |
---|---|
Formula | C13H15NO8 |
IUPAC Name | (2s,3s,4s,5r,6s)-6-(2-aminobenzoyl)oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid |
Molecular Mass | 313.260 g·mol−1 |
Heat of Formation | -1358.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.27 ± 1.08 D |
Volume | 335.1 Å 3 |
Surface Area | 299.93 Å 2 |
HOMO Energy | -8.86 ± 0.55 eV |
LUMO Energy | 2.38 ± eV |
Point Group Symmetry | C1 |
InChIKey | CDQXGNARPNZQNG-GUQUVYQDSA-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 |