8-Amino-2,6-Anhydro-3,8-Dideoxy-D-Glycero-D-Talo-Octonic Acid

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Properties Simple | Detailed

Formula C8H15NO6
IUPAC Name (2s,4r,5r,6r)-6-[(1r)-2-azaniumyl-1-hydroxy-ethyl]-4,5-dihydroxy-tetrahydropyran-2-carboxylate
Molecular Mass 221.208 g·mol−1
Heat of Formation -1127.6 ± 16.7 kJ·mol−1
Dipole Moment 5.97 ± 1.08 D
Volume 248.72 Å 3
Surface Area 225.86 Å 2
HOMO Energy -9.42 ± 0.55 eV
LUMO Energy 0.24 ± eV
Point Group Symmetry C1
Synonyms
  • (1,5-anhydro-7-amino-2,7-dideoxyheptopyranosyl)carboxylate
  • (2s,4r,5r,6r)-6-[(1r)-2-amino-1-hydroxy-ethyl]-4,5-dihydroxy-oxane-2-carboxylic acid
  • (2s,4r,5r,6r)-6-[(1r)-2-amino-1-hydroxy-ethyl]-4,5-dihydroxy-tetrahydropyran-2-carboxylic acid
  • (2s,4r,5r,6r)-6-[(1r)-2-amino-1-hydroxyethyl]-4,5-dihydroxy-2-tetrahydropyrancarboxylic acid
  • (2s,4r,5r,6r)-6-[(1r)-2-amino-1-hydroxyethyl]-4,5-dihydroxyoxane-2-carboxylic acid
  • 8-amino-2,6-dihydro-3,8-dideoxy-d-glycero-d-talo-octonic acid
  • aadhc
  • alpha-c-(1,5-anhydro-7-amino-2,7-dideoxy-d-manno-heptopyranosyl)carboxylate
  • d-glycero-d-talo-octonic acid, 8-amino-2,6-dihydro-3,8-dideoxy-
  • nh2dkdo
CAS Number(s)
  • 106174-48-5
InChIKey JOMLPRUJCYAJKS-XUUWZHRGSA-N
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