(4E,6E,8S,9S,10E,12S,13R,14S,16R)-19-(Allylamino)-13,20,22-Trihydroxy-8,14-Dimethoxy-4,10,12,16-Tetramethyl-3-Oxo-2-Azabicyclo[16.3.1]Docosa-1(22),4,6,10,18,20-Hexaen-9-Yl Carbamate

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Formula C31H45N3O8
IUPAC Name [(4e,6e,8s,9s,10e,12s,13r,14s,16r)-19-(allylamino)-13,20,22-trihydroxy-8,14-dimethoxy-4,10,12,16-tetramethyl-3-oxo-2-azabicyclo[16.3.1]docosa-1(22),4,6,10,18,20-hexaen-9-yl] carbamate
Molecular Mass 587.704 g·mol−1
Heat of Formation -1244.8 ± 16.7 kJ·mol−1
Dipole Moment 4.49 ± 1.08 D
Volume 734.29 Å 3
Surface Area 550.05 Å 2
HOMO Energy -7.77 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry C1
InChIKey OAKGNIRUXAZDQF-HTLBVUBBSA-N
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