(1R,2R,3S,4R,6S)-6-Amino-2-{[3-O-(2,6-Diamino-2,6-Dideoxy-α-D-Idopyranosyl)-Beta-D-Ribofuranosyl]Oxy}-3,4-Dihydroxycyclohexyl 2,6-Diamino-2,6-Dideoxy-α-D-Glucopyranoside

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Properties Simple | Detailed

Formula C23H45N5O14
IUPAC Name (2r,3s,4r,5r,6r)-5-amino-6-[(1r,2r,3s,4r,6s)-6-amino-2-[(2s,3r,4s,5r)-4-[(2r,3s,4s,5r,6r)-3-amino-6-(aminomethyl)-4,5-dihydroxy-tetrahydropyran-2-yl]oxy-3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]oxy-3,4-dihydroxy-cyclohexoxy]-2-(aminomethyl)tetrahydropyran-3,4-diol
Molecular Mass 615.628 g·mol−1
Heat of Formation -2627.5 ± 16.7 kJ·mol−1
Dipole Moment 2.93 ± 1.08 D
Volume 685.24 Å 3
Surface Area 505.61 Å 2
HOMO Energy -9.34 ± 0.55 eV
LUMO Energy 4.16 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s,4r,5r,6r)-5-amino-6-[(1r,2r,3s,4r,6s)-6-amino-2-[(2s,3r,4s,5r)-4-[(2r,3s,4s,5r,6r)-3-amino-6-(aminomethyl)-4,5-dihydroxy-oxan-2-yl]oxy-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3,4-dihydroxy-cyclohexyl]oxy-2-(aminomethyl)oxane-3,4-diol
  • (2r,3s,4r,5r,6r)-5-amino-6-[(1r,2r,3s,4r,6s)-6-amino-2-[(2s,3r,4s,5r)-4-[(2r,3s,4s,5r,6r)-3-amino-6-(aminomethyl)-4,5-dihydroxy-tetrahydropyran-2-yl]oxy-3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]oxy-3,4-dihydroxy-cyclohexoxy]-2-(aminomethyl)tetrahydropyran-3,4-diol
  • (2r,3s,4r,5r,6r)-5-amino-6-[(1r,2r,3s,4r,6s)-6-amino-2-[(2s,3r,4s,5r)-4-[(2r,3s,4s,5r,6r)-3-amino-6-(aminomethyl)-4,5-dihydroxy-tetrahydropyran-2-yl]oxy-3-hydroxy-5-methylol-tetrahydrofuran-2-yl]oxy-3,4-dihydroxy-cyclohexoxy]-2-(aminomethyl)tetrahydropyran-3,4-diol
  • (2r,3s,4r,5r,6r)-5-amino-6-[(1r,2r,3s,4r,6s)-6-amino-2-[[(2s,3r,4s,5r)-4-[[(2r,3s,4s,5r,6r)-3-amino-6-(aminomethyl)-4,5-dihydroxy-2-tetrahydropyranyl]oxy]-3-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]oxy]-3,4-dihydroxycyclohexoxy]-2-(aminomethyl)tetrahydropyran-3,4-diol
  • bmy-28162
  • bu 2659a
  • d-myo-inositol, o-2,6-diamino-2,6-dideoxy-alpha-d-glucopyranosyl-(1-4)-o-(o-2,6-diamino-2,6-dideoxy-beta-l-idopyranosyl-(1-3)-beta-d-ribofuranosyl-(1-5))-3-amino-2,3-dideoxy-
  • inosamycin a
CAS Number(s)
  • 91421-97-5
InChIKey HNBFTXDNUFWYJV-MXESDJFFSA-N
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