(11S,12R,12As,13Ar)-2-Hydroxy-3-Methoxy-8-Oxo-12-Vinyl-5,11,12,12A,13,13A-Hexahydro-6H,8H-Pyrano[4',3':4,5]Pyrido[2,1-A]Isoquinolin-11-Yl β-D-Glucopyranoside
Properties
| Property | Value |
|---|---|
| Formula | C25H31NO10 |
| IUPAC Name | (1r,15s,16r,17s)-4-hydroxy-5-methoxy-15-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-16-vinyl-14-oxa-10-azatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,12-tetraen-11-one |
| Molecular Mass | 505.514 g·mol−1 |
| Heat of Formation | -1585.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.55 ± 1.08 D |
| Volume | 568.14 Å 3 |
| Surface Area | 471.82 Å 2 |
| HOMO Energy | -8.67 ± 0.55 eV |
| LUMO Energy | -0.03 ± eV |
| Point Group Symmetry | C1 |
| CAS Number(s) |
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| InChIKey | BCYNGTTVQNJTCV-MDXCLUIBSA-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 |