(13α)-3-Hydroxy-2-Methoxyestra-1(10),2,4-Trien-17-One

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Formula C19H24O3
IUPAC Name (8s,9r,13r,14s)-3-hydroxy-2-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-17-one
Molecular Mass 300.392 g·mol−1
Heat of Formation -544.1 ± 16.7 kJ·mol−1
Dipole Moment 1.11 ± 1.08 D
Volume 370.39 Å 3
Surface Area 312.31 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy 3.06 ± eV
Point Group Symmetry C1
InChIKey WHEUWNKSCXYKBU-QUHUKJRKSA-N
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Elements H C O