Methyl (22α)-22-Hydroxy-3-Oxours-12-En-30-Oate
Properties
Property | Value |
---|---|
Formula | C31H48O4 |
IUPAC Name | methyl (1r,2r,4s,4ar,6ar,6as,6br,8as,12ar,14br)-4-hydroxy-1,4a,6a,6b,9,9,12a-heptamethyl-10-oxo-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-2-carboxylate |
Molecular Mass | 484.710 g·mol−1 |
Heat of Formation | -935.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.65 ± 1.08 D |
Volume | 608.04 Å 3 |
Surface Area | 439.31 Å 2 |
HOMO Energy | -9.18 ± 0.55 eV |
LUMO Energy | 4.08 ± eV |
Point Group Symmetry | C1 |
InChIKey | YQPSLCRGQUNTRC-JXIPVQOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |