(5S,8S,9R)-8-Benzoyl-2-[(1S,2S,3E)-1,2-Dihydroxy-3-Hexen-1-Yl]-9-Hydroxy-8-Methoxy-3-Methyl-1-Oxa-7-Azaspiro[4.4]Non-2-Ene-4,6-Dione
Properties
| Property | Value |
|---|---|
| Formula | C22H25NO8 |
| IUPAC Name | (5s,8s,9r)-8-benzoyl-2-[(e,1s,2s)-1,2-dihydroxyhex-3-enyl]-9-hydroxy-8-methoxy-3-methyl-1-oxa-7-azaspiro[4.4]non-2-ene-4,6-dione |
| Molecular Mass | 431.436 g·mol−1 |
| Heat of Formation | -1172.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.53 ± 1.08 D |
| Volume | 501.99 Å 3 |
| Surface Area | 376.34 Å 2 |
| HOMO Energy | -9.79 ± 0.55 eV |
| LUMO Energy | -0.60 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SLYDIPAXCVVRNY-VXBYYLFASA-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 |