(5S)-2,3-Anhydro-4-Deoxy-5-{(1S)-1-[(4Ar,5As,6Ar,12As,12Br)-7-Hydroxy-12B-Methyl-1-Oxo-1,5A,6,6A,11,12,12A,12B-Octahydro-4H-Chryseno[6,6A-B]Oxiren-9-Yl]Ethyl}-α-L-Erythro-Pentopyranose
Properties
Property | Value |
---|---|
Formula | C26H30O6 |
IUPAC Name | (5s)-2,3-anhydro-4-deoxy-5-{(1s)-1-[(4ar,5as,6ar,12as,12br)-7-hydroxy-12b-methyl-1-oxo-1,5a,6,6a,11,12,12a,12b-octahydro-4h-chryseno[6,6a-b]oxiren-9-yl]ethyl}-α-l-erythro-pentopyranose |
Molecular Mass | 438.513 g·mol−1 |
Heat of Formation | -752.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.05 ± 1.08 D |
Volume | 508.37 Å 3 |
Surface Area | 407.66 Å 2 |
HOMO Energy | -8.97 ± 0.55 eV |
LUMO Energy | 2.74 ± eV |
Point Group Symmetry | C1 |
InChIKey | CVRYGWHDQSLOBX-UMWNNHGQSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |