(20R)-17,20,21-Trihydroxypregn-4-En-3-One

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Formula C21H32O4
IUPAC Name (8r,9s,10r,13s,14s,17r)-17-[(1r)-1,2-dihydroxyethyl]-17-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthren-3-one
Molecular Mass 348.476 g·mol−1
Heat of Formation -889.1 ± 16.7 kJ·mol−1
Dipole Moment 2.44 ± 1.08 D
Volume 434.45 Å 3
Surface Area 340.2 Å 2
HOMO Energy -9.83 ± 0.55 eV
LUMO Energy -0.06 ± eV
Point Group Symmetry C1
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InChIKey XNFSGLNHLVHCFT-RMWFXKKMSA-N
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Elements H C O