[(2S,3R,4R,4As,10Br)-3,4,8,10-Tetrahydroxy-9-Methoxy-6-Oxo-2,3,4,4A,6,10B-Hexahydropyrano[3,2-C]Isochromen-2-Yl]Methyl 4-Hydroxy-3,5-Dimethoxybenzoate
Properties
| Property | Value |
|---|---|
| Formula | C23H24O13 |
| IUPAC Name | [(2s,3r,4s,4as,10br)-3,4,8,10-tetrahydroxy-9-methoxy-6-oxo-3,4,4a,10b-tetrahydro-2h-pyrano[3,2-c]isochromen-2-yl]methyl 4-hydroxy-3,5-dimethoxy-benzoate |
| Molecular Mass | 508.429 g·mol−1 |
| Heat of Formation | -2001.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.63 ± 1.08 D |
| Volume | 544.36 Å 3 |
| Surface Area | 414.33 Å 2 |
| HOMO Energy | -8.91 ± 0.55 eV |
| LUMO Energy | -1.08 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | GXCBETDJJWPGAQ-JNBGTJMESA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |