(17α)-3-Hydroxy-19-Norpregna-1,3,5(10)-Trien-20-Yn-17-Yl Hydrogen Sulfate
Properties
Property | Value |
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Formula | C20H24O5S |
IUPAC Name | [(8r,9s,13s,14s,17r)-17-ethynyl-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-17-yl] hydrogen sulfate |
Molecular Mass | 376.467 g·mol−1 |
Heat of Formation | -673.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.38 ± 1.08 D |
Volume | 391.17 Å 3 |
Surface Area | 310.99 Å 2 |
HOMO Energy | -8.89 ± 0.55 eV |
LUMO Energy | -0.21 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | JHKCCDZKVDAGJH-SLHNCBLASA-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 |