(2S)-3-(3,4-Dihydroxyphenyl)-2-({[(2R,3S,4R,5R)-2,3,4,5-Tetrahydroxytetrahydro-2H-Pyran-2-Yl]Methyl}Amino)Propanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C15H21NO9 |
| IUPAC Name | (2s)-3-(3,4-dihydroxyphenyl)-2-[[(2r,3s,4r,5r)-2,3,4,5-tetrahydroxytetrahydropyran-2-yl]methylamino]propanoic acid |
| Molecular Mass | 359.329 g·mol−1 |
| Heat of Formation | -1611.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.11 ± 1.08 D |
| Volume | 396.54 Å 3 |
| Surface Area | 344.36 Å 2 |
| HOMO Energy | -8.88 ± 0.55 eV |
| LUMO Energy | -0.21 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CMJMNLLULOWDQJ-RPMKOLLGSA-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 |