(6α)-3,6-Dihydroxyestra-1,3,5(10)-Trien-17-One
Properties
Property | Value |
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Formula | C18H22O3 |
IUPAC Name | (6s,8r,9s,13s,14s)-3,6-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-17-one |
Molecular Mass | 286.365 g·mol−1 |
Heat of Formation | -536.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.48 ± 1.08 D |
Volume | 349.93 Å 3 |
Surface Area | 293.27 Å 2 |
HOMO Energy | -8.94 ± 0.55 eV |
LUMO Energy | 0.05 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | HTORTGVWUGQTHQ-WUAUYOTNSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |