Apramycin

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Properties Simple | Detailed

Formula C21H41N5O11
IUPAC Name (2r,3r,4s,5s,6s)-2-[[(2r,3s,4r,4ar,6s,7r,8as)-7-amino-6-[(1r,2r,3s,4r,6s)-4,6-bis(λ1-azanyl)-2,3-dioxido-cyclohexoxy]-3-(methylamino)-4-oxido-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-2-yl]oxy]-5-λ1-azanyl-6-(oxidomethyl)tetrahydropyran-3,4,5,6-tetraide-3,4-diolate
Molecular Mass 539.577 g·mol−1
Heat of Formation -2028.5 ± 16.7 kJ·mol−1
Dipole Moment 6.06 ± 1.08 D
Volume 621.12 Å 3
Surface Area 483.05 Å 2
HOMO Energy -9.37 ± 0.55 eV
LUMO Energy 1.07 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5s,6s)-2-[[(2s,3r,4as,6r,7s,8r,8ar)-3-amino-2-[(1r,2r,3s,4r,6s)-4,6-diamino-2,3-dihydroxy-cyclohexoxy]-8-hydroxy-7-methylamino-2,3,4,4a,6,7,8,8a-octahydropyrano[2,3-e]pyran-6-yl]oxy]-5-amino-6-(hydroxymethyl)tetrahydropyran-3,4-diol
  • (2r,3r,4s,5s,6s)-2-[[(2s,3r,4as,6r,7s,8r,8ar)-3-amino-2-[(1r,2r,3s,4r,6s)-4,6-diamino-2,3-dihydroxy-cyclohexoxy]-8-hydroxy-7-methylamino-2,3,4,4a,6,7,8,8a-octahydropyrano[2,3-e]pyran-6-yl]oxy]-5-amino-6-methylol-tetrahydropyran-3,4-diol
  • (2r,3r,4s,5s,6s)-2-[[(2s,3r,4as,6r,7s,8r,8ar)-3-amino-2-[(1r,2r,3s,4r,6s)-4,6-diamino-2,3-dihydroxy-cyclohexyl]oxy-8-hydroxy-7-methylamino-2,3,4,4a,6,7,8,8a-octahydropyrano[2,3-e]pyran-6-yl]oxy]-5-amino-6-(hydroxymethyl)oxane-3,4-diol
  • (2r,3r,4s,5s,6s)-2-[[(2s,3r,4as,6r,7s,8r,8ar)-3-amino-2-[(1r,2r,3s,4r,6s)-4,6-diamino-2,3-dihydroxycyclohexoxy]-8-hydroxy-7-methylamino-2,3,4,4a,6,7,8,8a-octahydropyrano[2,3-e]pyran-6-yl]oxy]-5-amino-6-(hydroxymethyl)tetrahydropyran-3,4-diol
  • (2r,3r,4s,5s,6s)-2-[[(2s,3r,4as,6r,7s,8r,8ar)-3-amino-2-[(1r,2r,3s,4r,6s)-4,6-diamino-2,3-dihydroxycyclohexyl]oxy-8-hydroxy-7-methylamino-2,3,4,4a,6,7,8,8a-octahydropyrano[2,3-e]pyran-6-yl]oxy]-5-amino-6-(hydroxymethyl)oxane-3,4-diol
  • am2
  • nebramycin ii, 4-o-(3alpha-amino-6alpha-((4-amino-4-deoxy-alpha-d-glucopyranosyl)oxy)-2,3,4,5abeta,6,7,8,8aalpha-octahydro-8beta-hydroxy-7beta-(methylamino)pyrano(3,2-b)pyran-2alpha-yl)-2-deoxy-d-streptamine
InChIKey XZNUGFQTQHRASN-XQENGBIVSA-N
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