(2R,3R,4S,5R,6E)-N-(2,3-Dihydro-1H-Inden-2-Yl)-3,4,5-Trihydroxy-2-Methoxy-8,8-Dimethyl-6-Nonenamide
Properties
Property | Value |
---|---|
Formula | C21H31NO5 |
IUPAC Name | (e,2r,3r,4s,5r)-3,4,5-trihydroxy-n-indan-2-yl-2-methoxy-8,8-dimethyl-non-6-enamide |
Molecular Mass | 377.475 g·mol−1 |
Heat of Formation | -928.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.32 ± 1.08 D |
Volume | 477.23 Å 3 |
Surface Area | 416.32 Å 2 |
HOMO Energy | -9.23 ± 0.55 eV |
LUMO Energy | 0.04 ± eV |
Point Group Symmetry | C1 |
InChIKey | XTHOIFAGDPGJPZ-PQQJDVFMSA-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 |