(6β,8Xi,9Xi,10Xi,13Xi,14Xi)-6,11,17,21-Tetrahydroxypregn-4-Ene-3,20-Dione

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Formula C21H30O6
IUPAC Name (6s,8s,9s,10r,11s,13s,14r,17s)-6,11,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthren-3-one
Molecular Mass 378.459 g·mol−1
Heat of Formation -1136.8 ± 16.7 kJ·mol−1
Dipole Moment 7.87 ± 1.08 D
Volume 442.53 Å 3
Surface Area 346.2 Å 2
HOMO Energy -9.71 ± 0.55 eV
LUMO Energy 0.04 ± eV
Point Group Symmetry C1
InChIKey GNFTWPCIRXSCQF-IDPVYNNJSA-N
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