(11β,17Xi)-11-Methoxy-19-Norpregna-1(10),2,4-Trien-20-Yne-2,3,17-Triol
Properties
Property | Value |
---|---|
Formula | C21H26O4 |
IUPAC Name | (8s,9s,11s,13s,14s,17s)-17-ethynyl-11-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthrene-2,3,17-triol |
Molecular Mass | 342.429 g·mol−1 |
Heat of Formation | -496.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.51 ± 1.08 D |
Volume | 377.11 Å 3 |
Surface Area | 295.04 Å 2 |
HOMO Energy | -8.42 ± 0.55 eV |
LUMO Energy | 0.26 ± eV |
Point Group Symmetry | C1 |
InChIKey | XXEKFEBZBPGIAP-CBPODPTPSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |