20,21-Dihydroxy-18,20-Epoxypregn-4-En-3-One
Properties
Property | Value |
---|---|
Formula | C21H30O4 |
IUPAC Name | (1r,2s,5s,6r,9r,12s,13r)-6-hydroxy-6-(hydroxymethyl)-13-methyl-7-oxapentacyclo[10.8.0.02,9.05,9.013,18]icos-17-en-16-one |
Molecular Mass | 346.461 g·mol−1 |
Heat of Formation | -828.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.25 ± 1.08 D |
Volume | 425.27 Å 3 |
Surface Area | 336.22 Å 2 |
HOMO Energy | -9.84 ± 0.55 eV |
LUMO Energy | -0.07 ± eV |
Point Group Symmetry | C1 |
InChIKey | GPYDBMQOMJCWRO-XYIAWKELSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |