Aceroside B1
Properties
| Property | Value |
|---|---|
| Formula | C25H32O8 |
| IUPAC Name | (2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-[[(10r)-10-hydroxy-2-oxatricyclo[13.2.2.13,7]icosa-1(18),3,5,7(20),15(19),16-hexaen-4-yl]oxy]tetrahydropyran-3,4,5-triol |
| Molecular Mass | 460.517 g·mol−1 |
| Heat of Formation | -1331.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.85 ± 1.08 D |
| Volume | 545.67 Å 3 |
| Surface Area | 425.82 Å 2 |
| HOMO Energy | -9.35 ± 0.55 eV |
| LUMO Energy | -0.40 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JTRDCQXYJNZURE-SQESJSQNSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |