N-[(3β,5Alpha)-3-(Dimethylamino)Pregnan-20-Yl]-N-Methylacetamide

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Formula C26H46N2O
IUPAC Name n-[(1s)-1-[(3s,5s,8r,9s,10s,13s,14s,17s)-3-(dimethylamino)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-17-yl]ethyl]-n-methyl-acetamide
Molecular Mass 402.656 g·mol−1
Heat of Formation -459.5 ± 16.7 kJ·mol−1
Dipole Moment 2.76 ± 1.08 D
Volume 546.26 Å 3
Surface Area 422.15 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy 1.63 ± eV
Point Group Symmetry C1
InChIKey VPOYXIYUORUTSW-VCJWWASDSA-N
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