Methyl [9,9',10,10'-Tetrahydroxy-7,7'-Dimethoxy-1,1'-Dioxo-3'-(2-Oxopropyl)-3,3',4,4'-Tetrahydro-1H,1'H-8,8'-Bibenzo[G]Isochromen-3-Yl]Acetate
Properties
| Property | Value |
|---|---|
| Formula | C34H30O13 |
| IUPAC Name | methyl 2-[(3r)-8-[(3r)-3-acetonyl-9,10-dihydroxy-7-methoxy-1-oxo-3,4-dihydrobenzo[g]isochromen-8-yl]-9,10-dihydroxy-7-methoxy-1-oxo-3,4-dihydrobenzo[g]isochromen-3-yl]acetate |
| Molecular Mass | 646.594 g·mol−1 |
| Heat of Formation | -2080.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 11.32 ± 1.08 D |
| Volume | 690.26 Å 3 |
| Surface Area | 574.99 Å 2 |
| HOMO Energy | -8.77 ± 0.55 eV |
| LUMO Energy | -1.28 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OSOGRLZVVUKNOT-RBUKOAKNSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |