(8R,9R,13S,14R,17S)-13-Ethyl-17-Ethynyl-3-Methoxy-7,8,9,11,12,13,14,15,16,17-Decahydro-6H-Cyclopenta[A]Phenanthren-17-Ol
Properties
Property | Value |
---|---|
Formula | C22H28O2 |
IUPAC Name | (8r,9s,13r,14s,17s)-13-ethyl-17-ethynyl-3-methoxy-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-17-ol |
Molecular Mass | 324.457 g·mol−1 |
Heat of Formation | -169.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.88 ± 1.08 D |
Volume | 374.03 Å 3 |
Surface Area | 299.21 Å 2 |
HOMO Energy | -8.65 ± 0.55 eV |
LUMO Energy | 0.31 ± eV |
Point Group Symmetry | C1 |
InChIKey | NXKYEZGQCNWQRT-QMCAAQAGSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |