(2R,3S,4R,4Ar,6S,7R,8As)-7-Amino-6-{[(1R,2R,3S,4R,6S)-4-Amino-2,3,6-Trihydroxycyclohexyl]Oxy}-4-Hydroxy-3-(Methylamino)Octahydropyrano[3,2-B]Pyran-2-Yl α-D-Glucopyranoside

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Properties Simple | Detailed

Formula C21H39N3O13
IUPAC Name (2r,3r,4s,5s,6r)-2-[[(2r,3s,4r,4ar,6s,7r,8as)-7-amino-6-[(1r,2r,3s,4r,6s)-4-amino-2,3,6-trihydroxy-cyclohexoxy]-4-hydroxy-3-(methylamino)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-2-yl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 541.547 g·mol−1
Heat of Formation -2412.5 ± 16.7 kJ·mol−1
Dipole Moment 4.67 ± 1.08 D
Volume 611.6 Å 3
Surface Area 480.98 Å 2
HOMO Energy -9.42 ± 0.55 eV
LUMO Energy 1.11 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5s,6r)-2-[[(2s,3r,4as,6r,7s,8r,8ar)-3-amino-2-[(1r,2r,3s,4r,6s)-4-amino-2,3,6-trihydroxy-cyclohexoxy]-8-hydroxy-7-methylamino-2,3,4,4a,6,7,8,8a-octahydropyrano[2,3-e]pyran-6-yl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
  • (2r,3r,4s,5s,6r)-2-[[(2s,3r,4as,6r,7s,8r,8ar)-3-amino-2-[(1r,2r,3s,4r,6s)-4-amino-2,3,6-trihydroxy-cyclohexoxy]-8-hydroxy-7-methylamino-2,3,4,4a,6,7,8,8a-octahydropyrano[2,3-e]pyran-6-yl]oxy]-6-methylol-tetrahydropyran-3,4,5-triol
  • (2r,3r,4s,5s,6r)-2-[[(2s,3r,4as,6r,7s,8r,8ar)-3-amino-2-[(1r,2r,3s,4r,6s)-4-amino-2,3,6-trihydroxy-cyclohexyl]oxy-8-hydroxy-7-methylamino-2,3,4,4a,6,7,8,8a-octahydropyrano[2,3-e]pyran-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
  • (2r,3r,4s,5s,6r)-2-[[(2s,3r,4as,6r,7s,8r,8ar)-3-amino-2-[(1r,2r,3s,4r,6s)-4-amino-2,3,6-trihydroxycyclohexoxy]-8-hydroxy-7-methylamino-2,3,4,4a,6,7,8,8a-octahydropyrano[2,3-e]pyran-6-yl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
  • (2r,3r,4s,5s,6r)-2-[[(2s,3r,4as,6r,7s,8r,8ar)-3-amino-2-[(1r,2r,3s,4r,6s)-4-amino-2,3,6-trihydroxycyclohexyl]oxy-8-hydroxy-7-methylamino-2,3,4,4a,6,7,8,8a-octahydropyrano[2,3-e]pyran-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
  • 4''-deamino-4''-hydroxyapramycin
  • d-streptamine, o-alpha-d-glucopyranosyl-(1-8)-o-(8r)-2-amino-2,3,7-trideoxy-7-(methylamino)-d-glycero-alpha-d-allo-octodialdo-1,5:8,4-dipyranosyl-(1-4)-2-deoxy-
  • ka 5685
  • saccharocin
CAS Number(s)
  • 86630-31-1
InChIKey CANJCXYUUJPQSP-OKXNOFASSA-N
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