5-(4-Hydroxy-5-Methoxy-2-Methyl-Decalin-1,2,3,4,4A,5,6,7,8,8A-Decaid-1-Yl)-3-(Hydroxymethyl)-8-Methoxy-1-Methyl-4,7-Dihydro-2H-Isoquinoline-1,3,4,4A,5,7,8,8A-Octaid-6-One
Properties
| Property | Value |
|---|---|
| Formula | C24H42NO5+ |
| IUPAC Name | (1r,3r,4as,5s,8s,8as)-5-[(1s,2s,4s,4as,5r,8as)-4-hydroxy-5-methoxy-2-methyl-decalin-1-yl]-3-(hydroxymethyl)-8-methoxy-1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1h-isoquinolin-2-ium-6-one |
| Molecular Mass | 424.594 g·mol−1 |
| Heat of Formation | -595.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.40 ± 1.08 D |
| Volume | 469.81 Å 3 |
| Surface Area | 395.37 Å 2 |
| HOMO Energy | -7.84 ± 0.55 eV |
| LUMO Energy | -0.96 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IKBNYFKUWPALMT-UHFFFAOYSA-O |
| QR Code | Generate QR Code |
| Links | |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |