[(2R,3S,4Ar,5As,10Ar,11R,11As)-11-Hydroxy-3-(Methoxymethoxy)-2,3,4,4A,5A,6,9,10A,11,11A-Decahydropyrano[2',3':5,6]Pyrano[3,2-B]Oxepin-2-Yl]Acetic Acid
Properties
| Property | Value |
|---|---|
| Formula | C16H24O8 |
| IUPAC Name | 2-[(1s,3r,5s,6r,8s,9r,10r)-9-hydroxy-5-(methoxymethoxy)-2,7,11-trioxatricyclo[8.5.0.03,8]pentadec-13-en-6-yl]acetic acid |
| Molecular Mass | 344.357 g·mol−1 |
| Heat of Formation | -1394.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.11 ± 1.08 D |
| Volume | 397.18 Å 3 |
| Surface Area | 342.02 Å 2 |
| HOMO Energy | -9.71 ± 0.55 eV |
| LUMO Energy | 3.62 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BUTGPEQQPCQQSZ-RQHZCWAZSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |