14-[(2R,3R,4S,5S,6R)-3-[(2R,3R,4R,5S,6R)-3-Amino-5-Hydroxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4,5-Dihydroxy-4,6-Dimethyl-Tetrahydropyran-2-Yl]Oxy-20-Hydroxy-11-Methyl-Blahe-22,23-Dione

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Formula C33H51NO13
IUPAC Name 14-[(2r,3r,4s,5s,6r)-3-[(2r,3r,4r,5s,6r)-3-amino-5-hydroxy-4-methoxy-6-methyl-tetrahydropyran-2-yl]oxy-4,5-dihydroxy-4,6-dimethyl-tetrahydropyran-2-yl]oxy-20-hydroxy-11-methyl-blahe-22,23-dione
Molecular Mass 669.757 g·mol−1
Heat of Formation -2063.8 ± 16.7 kJ·mol−1
Dipole Moment 7.78 ± 1.08 D
Volume 703.15 Å 3
Surface Area 525.36 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy 1.49 ± eV
Point Group Symmetry C1
InChIKey SDEPJSSWBXSAFL-KWJIQSIXSA-O
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