3-{[(7α,8Xi)-3,20-Dioxopregn-4-En-7-Yl]Sulfanyl}Propanoic Acid
Properties
Property | Value |
---|---|
Formula | C24H34O4S |
IUPAC Name | 3-[(17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-yl)sulfanyl]propanoic acid |
Molecular Mass | 418.589 g·mol−1 |
Heat of Formation | -860.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.33 ± 1.08 D |
Volume | 512.69 Å 3 |
Surface Area | 384.16 Å 2 |
HOMO Energy | -8.85 ± 0.55 eV |
LUMO Energy | -0.14 ± eV |
Point Group Symmetry | C1 |
InChIKey | BOJZZBMFGDYFER-XOYRLYHHSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O |