(2R)-4-Amino-N-{(1R,2S,3R,4R,5S)-5-Amino-2-{2-[(2-Aminoethyl)Amino]Ethoxy}-4-[(2,6-Diamino-2,6-Dideoxy-α-D-Glucopyranosyl)Oxy]-3-Hydroxycyclohexyl}-2-Hydroxybutanamide

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Properties Simple | Detailed

Formula C20H43N7O8
IUPAC Name (2r)-4-amino-n-[(1r,2s,3r,4r,5s)-5-amino-4-[(2r,3r,4r,5s,6r)-3-amino-6-(aminomethyl)-4,5-dihydroxy-tetrahydropyran-2-yl]oxy-2-[2-(2-aminoethylamino)ethoxy]-3-hydroxy-cyclohexyl]-2-hydroxy-butanamide
Molecular Mass 509.598 g·mol−1
Heat of Formation -1510.1 ± 16.7 kJ·mol−1
Dipole Moment 7.16 ± 1.08 D
Volume 620.04 Å 3
Surface Area 493.24 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy 0.92 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-4-amino-n-[(1r,2s,3r,4r,5s)-5-amino-4-[(2r,3r,4r,5s,6r)-3-amino-6-(aminomethyl)-4,5-dihydroxy-oxan-2-yl]oxy-2-[2-(2-aminoethylamino)ethoxy]-3-hydroxy-cyclohexyl]-2-hydroxy-butanamide
  • (2r)-4-amino-n-[(1r,2s,3r,4r,5s)-5-amino-4-[(2r,3r,4r,5s,6r)-3-amino-6-(aminomethyl)-4,5-dihydroxy-tetrahydropyran-2-yl]oxy-2-[2-(2-aminoethylamino)ethoxy]-3-hydroxy-cyclohexyl]-2-hydroxy-butanamide
  • (2r)-4-amino-n-[(1r,2s,3r,4r,5s)-5-amino-4-[(2r,3r,4r,5s,6r)-3-amino-6-(aminomethyl)-4,5-dihydroxy-tetrahydropyran-2-yl]oxy-2-[2-(2-aminoethylamino)ethoxy]-3-hydroxy-cyclohexyl]-2-hydroxy-butyramide
  • (2r)-4-amino-n-[(1r,2s,3r,4r,5s)-5-amino-4-[(2r,3r,4r,5s,6r)-3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy-2-[2-(2-aminoethylamino)ethoxy]-3-hydroxycyclohexyl]-2-hydroxybutanamide
  • (2r)-4-amino-n-[(1r,2s,3r,4r,5s)-5-amino-4-[[(2r,3r,4r,5s,6r)-3-amino-6-(aminomethyl)-4,5-dihydroxy-2-tetrahydropyranyl]oxy]-2-[2-(2-aminoethylamino)ethoxy]-3-hydroxycyclohexyl]-2-hydroxybutanamide
  • ab9
InChIKey OGRDTONULPXNRP-HSDDYVLRSA-N
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