1-[(2R)-2-{(1S,2S)-8-[(3R,4R,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)-2-Pyrrolidinyl]-1,2-Dihydroxyoctyl}-1-Piperidinyl]Ethanone

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Properties Simple | Detailed

Formula C20H38N2O6
IUPAC Name 1-[(2r)-2-[(1s,2s)-8-[(2s,3r,4r,5r)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]-1,2-dihydroxy-octyl]-1-piperidyl]ethanone
Molecular Mass 402.526 g·mol−1
Heat of Formation -1321.7 ± 16.7 kJ·mol−1
Dipole Moment 8.94 ± 1.08 D
Volume 512.49 Å 3
Surface Area 443.51 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy 4.72 ± eV
Point Group Symmetry C1
InChIKey JOZUWNJNFDODBK-QDWVOHSCSA-N
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