Validoxylamine A 6'-O-Phosphate

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Formula C14H26NO11P
IUPAC Name [(1r,2r,3s,4s,5s)-2,3,4-trihydroxy-5-[[(1s,4r,5s,6s)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]cyclohexyl]methyl dihydrogen phosphate
Molecular Mass 415.330 g·mol−1
Heat of Formation -2367.7 ± 16.7 kJ·mol−1
Dipole Moment 11.69 ± 1.08 D
Volume 442.82 Å 3
Surface Area 367.11 Å 2
HOMO Energy -9.57 ± 0.55 eV
LUMO Energy -0.20 ± eV
Point Group Symmetry C1
InChIKey ZKSTYMJGEHZSFH-MBABXGOBSA-N
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