Cnicine
Properties
Property | Value |
---|---|
Formula | C20H26O7 |
IUPAC Name | [(3ar,4s,6e,10z,11ar)-10-(hydroxymethyl)-6-methyl-3-methylene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (3s)-3,4-dihydroxy-2-methylene-butanoate |
Molecular Mass | 378.416 g·mol−1 |
Heat of Formation | -1089.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.65 ± 1.08 D |
Volume | 454.1 Å 3 |
Surface Area | 366.68 Å 2 |
HOMO Energy | -9.71 ± 0.55 eV |
LUMO Energy | -0.92 ± eV |
Point Group Symmetry | C1 |
InChIKey | ZTDFZLVUIVPZDU-NXZIYWCUSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |