(2S,3S,4S,5S,6R)-5-Acetoxy-3-Hydroxy-2-(1-Hydroxy-10,12-Dimethoxy-6-Oxo-8-Vinyl-Naphtho[1,2-C]Isochromen-4-Yl)-N,N,6-Trimethyl-Tetrahydropyran-4-Amine Oxide

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Properties Simple | Detailed

Formula C31H35NO10++
IUPAC Name (2s,3s,4s,5s,6r)-5-acetoxy-3-hydroxy-2-(1-hydroxy-10,12-dimethoxy-6-oxo-8-vinyl-naphtho[1,2-c]isochromen-4-yl)-n,n,6-trimethyl-tetrahydropyran-4-amine oxide
Molecular Mass 581.610 g·mol−1
Heat of Formation -1241.8 ± 16.7 kJ·mol−1
Dipole Moment 6.33 ± 1.08 D
Volume 651.08 Å 3
Surface Area 502.98 Å 2
HOMO Energy -8.32 ± 0.55 eV
LUMO Energy 1.72 ± eV
Point Group Symmetry C1
InChIKey HGSYVRZYHJUZAT-CXDINUQGSA-P
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