[(1S,2R,3S)-1-[(1S)-2-[(1S,2R,3S,4S)-3,4-Dihydroxy-2-(Hydroxymethyl)Tetrahydrothiophen-1-Ium-1-Yl]-1-Hydroxy-Ethyl]-2,3,4-Trihydroxy-Butyl] Sulfate
Properties
| Property | Value |
|---|---|
| Formula | C11H24O11S2 |
| IUPAC Name | [(1s,2r,3s)-1-[(1s)-2-[(1s,2r,3s,4s)-3,4-dihydroxy-2-(hydroxymethyl)-1λ4-thiolan-1-yl]-1-hydroxy-ethyl]-2,3,4-trihydroxy-butyl] hydrogen sulfate |
| Molecular Mass | 396.432 g·mol−1 |
| Heat of Formation | -2049.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 11.12 ± 1.08 D |
| Volume | 398.39 Å 3 |
| Surface Area | 318.52 Å 2 |
| HOMO Energy | -9.97 ± 0.55 eV |
| LUMO Energy | -1.87 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JLIZZBHQYALROX-CTPKJSQQSA-N |
| QR Code | Generate QR Code |
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| Elements | H S C O |