3-({3-[(1S,5S,6R,7S,9S,10S)-5,9-Dimethyl-4-Oxo-8-Oxatetracyclo[7.2.1.1~7,10~.0~1,6~]Tridec-5-Yl]Propanoyl}Amino)-2,4-Dihydroxybenzoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C24H29NO7 |
| IUPAC Name | 3-({3-[(1s,5s,6r,7s,9s,10s)-5,9-dimethyl-4-oxo-8-oxatetracyclo[7.2.1.1 7,10 .0 1,6 ]tridec-5-yl]propanoyl}amino)-2,4-dihydroxybenzoic acid |
| Molecular Mass | 443.490 g·mol−1 |
| Heat of Formation | -1265.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.01 ± 1.08 D |
| Volume | 505.95 Å 3 |
| Surface Area | 415.98 Å 2 |
| HOMO Energy | -8.81 ± 0.55 eV |
| LUMO Energy | 2.34 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XADCWKSMHQPTGH-OFBLZTNGSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |