Methyl {(1R,4Z,8S,13E)-8-{[4,6-Dideoxy-4-(Hydroxyamino)-β-D-Glucopyranosyl]Oxy}-1-Hydroxy-13-[2-(Methyltrisulfanyl)Ethylidene]-11-Oxobicyclo[7.3.1]Trideca-4,9-Diene-2,6-Diyn-10-Yl}Carbamate
Properties
| Property | Value |
|---|---|
| Formula | C24H28N2O9S3 |
| IUPAC Name | methyl n-[(1r,4z,8s,13e)-8-[(2r,3r,4s,5s,6r)-3,4-dihydroxy-5-(hydroxyamino)-6-methyl-tetrahydropyran-2-yl]oxy-1-hydroxy-13-[2-(methyltrisulfanyl)ethylidene]-11-oxo-10-bicyclo[7.3.1]trideca-4,9-dien-2,6-diynyl]carbamate |
| Molecular Mass | 584.682 g·mol−1 |
| Heat of Formation | -816.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.56 ± 1.08 D |
| Volume | 651.74 Å 3 |
| Surface Area | 497.97 Å 2 |
| HOMO Energy | -8.85 ± 0.55 eV |
| LUMO Energy | -1.43 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | HIXBTEQHDWBCIJ-JZCXNSNGSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |