(2R,3S,4S,5R,6S,7R)-6-Amino-2,3,4,5-Tetrahydroxy-7-Methoxyoctanal

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Properties Simple | Detailed

Formula C9H19NO6
IUPAC Name (2r,3s,4s,5r,6s,7r)-6-amino-2,3,4,5-tetrahydroxy-7-methoxy-octanal
Molecular Mass 237.250 g·mol−1
Heat of Formation -1135.2 ± 16.7 kJ·mol−1
Dipole Moment 3.08 ± 1.08 D
Volume 284.74 Å 3
Surface Area 253.54 Å 2
HOMO Energy -9.76 ± 0.55 eV
LUMO Energy 0.43 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s,4s,5r,6s,7r)-6-amino-2,3,4,5-tetrahydroxy-7-methoxy-caprylaldehyde
  • (2r,3s,4s,5r,6s,7r)-6-amino-2,3,4,5-tetrahydroxy-7-methoxy-octanal
  • 6-amino-6,8-dideoxy-7-0-methyl-d-erythro-d-galacto-octose
  • celestosamine
  • d-erythro-d-galacto-octose, 6-amino-6,8-dideoxy-7-o-methyl-
CAS Number(s)
  • 75919-70-9
InChIKey HIQUUSNBAJBMPX-GWKQWKOUSA-N
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