(2R,3R,4R,5R)-2,3,4,5,8-Pentahydroxy-7-Oxooctyl 4-Amino-4-Deoxy-β-L-Arabinopyranoside

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Properties Simple | Detailed

Formula C13H25NO10
IUPAC Name (4r,5r,6r,7r)-8-[(2r,3r,4s,5s)-5-amino-3,4-dihydroxy-tetrahydropyran-2-yl]oxy-1,4,5,6,7-pentahydroxy-octan-2-one
Molecular Mass 355.338 g·mol−1
Heat of Formation -1892.9 ± 16.7 kJ·mol−1
Dipole Moment 3.13 ± 1.08 D
Volume 397.0 Å 3
Surface Area 324.36 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy -0.52 ± eV
Point Group Symmetry C1
Synonyms
  • (4r,5r,6r,7r)-8-[(2r,3r,4s,5s)-5-amino-3,4-dihydroxy-oxan-2-yl]oxy-1,4,5,6,7-pentahydroxy-octan-2-one
  • (4r,5r,6r,7r)-8-[(2r,3r,4s,5s)-5-amino-3,4-dihydroxy-tetrahydropyran-2-yl]oxy-1,4,5,6,7-pentahydroxy-octan-2-one
  • (4r,5r,6r,7r)-8-[(2r,3r,4s,5s)-5-amino-3,4-dihydroxyoxan-2-yl]oxy-1,4,5,6,7-pentahydroxyoctan-2-one
  • (4r,5r,6r,7r)-8-[[(2r,3r,4s,5s)-5-amino-3,4-dihydroxy-2-tetrahydropyranyl]oxy]-1,4,5,6,7-pentahydroxyoctan-2-one
  • 8-aadoa
  • 8-o-(4-amino-4-deoxy-beta-l-arabinopyranosyl)-3-deoxy-d-manno-octulosonic acid
  • 8-o-(4-amino-4-deoxyarabinopyranosyl)-3-deoxyoctulosonic acid
  • d-manno-2-octulose, 8-o-(4-amino-4-deoxy-beta-l-arabinopyranosyl)-3-deoxy-
CAS Number(s)
  • 118573-59-4
InChIKey UBEKUVHIWMWBDR-BMHOHNRESA-N
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