(1α,3α,6α,14α,16Beta)-20-Ethyl-1,6,16-Trimethoxy-4-(Methoxymethyl)Aconitane-3,8,13,14,15-Pentol
Properties
Property | Value |
---|---|
Formula | C25H41NO9 |
IUPAC Name | (1alpha,3alpha,6alpha,14alpha,16beta)-20-ethyl-1,6,16-trimethoxy-4-(methoxymethyl)aconitane-3,8,13,14,15-pentol |
Molecular Mass | 499.594 g·mol−1 |
Heat of Formation | -1641.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.13 ± 1.08 D |
Volume | 572.71 Å 3 |
Surface Area | 418.58 Å 2 |
HOMO Energy | -8.23 ± 0.55 eV |
LUMO Energy | 4.45 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | SQMGCPHFHQGPIF-UUKFDUHUSA-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 |