Methyl (2α,16Xi,17S,19E)-17-Hydroxy-22-Oxo-22-(3,4,5-Trimethoxyphenyl)Ajmal-19-En-16-Carboxylate
Properties
Property | Value |
---|---|
Formula | C31H34N2O7 |
IUPAC Name | methyl (2alpha,16xi,17s,19e)-17-hydroxy-22-oxo-22-(3,4,5-trimethoxyphenyl)ajmal-19-en-16-carboxylate |
Molecular Mass | 546.611 g·mol−1 |
Heat of Formation | -840.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.74 ± 1.08 D |
Volume | 626.04 Å 3 |
Surface Area | 472.21 Å 2 |
HOMO Energy | -8.66 ± 0.55 eV |
LUMO Energy | 2.62 ± eV |
Point Group Symmetry | C1 |
InChIKey | PRKMIRDXQCIYQP-GUTBXLRFSA-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 |