4,6-Dideoxy-4-{[(1S,4R,5R,6S)-4-{[4-O-(6-Deoxy-α-D-Glucopyranosyl)-α-D-Glucopyranosyl]Oxy}-5,6-Dihydroxy-3-(Hydroxymethyl)-2-Cyclohexen-1-Yl]Amino}-α-D-Glucopyranosyl-(1->4)-α-D-Glucopyranosyl-(1->4)-6-Deoxy-Beta-D-Glucopyranose

Molecule SVG Image

Properties Simple | Detailed

Formula C37H63NO26
IUPAC Name (2r,3r,4s,5s,6r)-2-[(2r,3s,4r,5r,6s)-6-[(1r,4s,5s,6r)-4-[[(2r,3s,4s,5r,6r)-6-[(2r,3s,4r,5r,6r)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2r,3s,4r,5r,6r)-4,5,6-trihydroxy-2-methyl-tetrahydropyran-3-yl]oxy-tetrahydropyran-3-yl]oxy-4,5-dihydroxy-2-methyl-tetrahydropyran-3-yl]amino]-5,6-dihydroxy-2-(hydroxymethyl)cyclohex-2-en-1-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-6-methyl-tetrahydropyran-3,4,5-triol
Molecular Mass 937.887 g·mol−1
Heat of Formation -4948.4 ± 16.7 kJ·mol−1
Dipole Moment 10.95 ± 1.08 D
Volume 1034.43 Å 3
Surface Area 761.27 Å 2
HOMO Energy -9.70 ± 0.55 eV
LUMO Energy -0.01 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5s,6r)-2-[(2r,3s,4r,5r,6s)-6-[[(1r,4s,5s,6r)-4-[[(2r,3s,4s,5r,6r)-6-[(2r,3s,4r,5r,6r)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2r,3s,4r,5r,6r)-4,5,6-trihydroxy-2-methyl-oxan-3-yl]oxy-oxan-3-yl]oxy-4,5-dihydroxy-2-methyl-oxan-3-yl]amino]-5,6-dihydroxy-2-(hydroxymethyl)-1-cyclohex-2-enyl]oxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-methyl-oxane-3,4,5-triol
  • (2r,3r,4s,5s,6r)-2-[(2r,3s,4r,5r,6s)-6-[[(1r,4s,5s,6r)-4-[[(2r,3s,4s,5r,6r)-6-[(2r,3s,4r,5r,6r)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2r,3s,4r,5r,6r)-4,5,6-trihydroxy-2-methyl-tetrahydropyran-3-yl]oxy-tetrahydropyran-3-yl]oxy-4,5-dihydroxy-2-methyl-tetrahydropyran-3-yl]amino]-5,6-dihydroxy-2-(hydroxymethyl)-1-cyclohex-2-enyl]oxy]-4,5-dihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-6-methyl-tetrahydropyran-3,4,5-triol
  • (2r,3r,4s,5s,6r)-2-[(2r,3s,4r,5r,6s)-6-[[(1r,4s,5s,6r)-4-[[(2r,3s,4s,5r,6r)-6-[(2r,3s,4r,5r,6r)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2r,3s,4r,5r,6r)-4,5,6-trihydroxy-2-methyloxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxy-2-methyloxan-3-yl]amino]-5,6-dihydroxy-2-(hydroxymethyl)-1-cyclohex-2-enyl]oxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol
  • (2r,3r,4s,5s,6r)-2-[(2r,3s,4r,5r,6s)-6-[[(1r,4s,5s,6r)-4-[[(2r,3s,4s,5r,6r)-6-[(2r,3s,4r,5r,6r)-4,5-dihydroxy-2-methylol-6-[(2r,3s,4r,5r,6r)-4,5,6-trihydroxy-2-methyl-tetrahydropyran-3-yl]oxy-tetrahydropyran-3-yl]oxy-4,5-dihydroxy-2-methyl-tetrahydropyran-3-yl]amino]-5,6-dihydroxy-2-methylol-1-cyclohex-2-enyl]oxy]-4,5-dihydroxy-2-methylol-tetrahydropyran-3-yl]oxy-6-methyl-tetrahydropyran-3,4,5-triol
  • (2r,3r,4s,5s,6r)-2-[[(2r,3s,4r,5r,6s)-6-[[(1r,4s,5s,6r)-4-[[(2r,3s,4s,5r,6r)-6-[[(2r,3s,4r,5r,6r)-4,5-dihydroxy-2-(hydroxymethyl)-6-[[(2r,3s,4r,5r,6r)-4,5,6-trihydroxy-2-methyl-3-tetrahydropyranyl]oxy]-3-tetrahydropyranyl]oxy]-4,5-dihydroxy-2-methyl-3-tetrahydropyranyl]amino]-5,6-dihydroxy-2-(hydroxymethyl)-1-cyclohex-2-enyl]oxy]-4,5-dihydroxy-2-(hydroxymethyl)-3-tetrahydropyranyl]oxy]-6-methyltetrahydropyran-3,4,5-triol
  • abc
  • modified acarbose hexasaccharide
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