(3S,4S,5R)-4,5-Dihydroxy-6-Oxo-3-[[(3S,4S,5R,6S)-4,5,6-Trihydroxy-2-Methylene-Tetrahydropyran-3-Yl]Amino]Cyclohexene-1-Carbaldehyde
Properties
| Property | Value |
|---|---|
| Formula | C13H17NO8 |
| IUPAC Name | (3s,4s,5r)-4,5-dihydroxy-6-oxo-3-[[(3s,4s,5r,6s)-4,5,6-trihydroxy-2-methylene-tetrahydropyran-3-yl]amino]cyclohexene-1-carbaldehyde |
| Molecular Mass | 315.276 g·mol−1 |
| Heat of Formation | -1230.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.99 ± 1.08 D |
| Volume | 345.5 Å 3 |
| Surface Area | 290.8 Å 2 |
| HOMO Energy | -9.80 ± 0.55 eV |
| LUMO Energy | -0.96 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZGWNRGISVMYHTF-KKXLKBQTSA-N |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |