Acarbose

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Properties Simple | Detailed

Formula C25H43NO18
IUPAC Name 6-[[(1r)-1-formylallyl]amino]-2,3-dioxo-4-(oxomethylene)hexa-4,5-dienal; (2s,4r,5s)-6-oxo-5-[(1s)-2-oxo-1-[4,5,6-trioxo-2-(oxomethylene)tetrahydropyran-3-id-3-yl]oxy-ethoxy]-1,3-dioxane-2,4-dicarbaldehyde
Molecular Mass 645.605 g·mol−1
Heat of Formation -3357.0 ± 16.7 kJ·mol−1
Dipole Moment 2.14 ± 1.08 D
Volume 716.58 Å 3
Surface Area 537.41 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy 0.29 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4r,5s,6r)-5-[(2r,3r,4r,5s,6r)-5-[(2r,3r,4s,5s,6r)-3,4-dihydroxy-6-methyl-5-[[(1s,4r,5s,6s)-4,5,6-trihydroxy-3-(hydroxymethyl)-1-cyclohex-2-enyl]amino]oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,3,4-triol
  • (2r,3r,4r,5s,6r)-5-[(2r,3r,4r,5s,6r)-5-[(2r,3r,4s,5s,6r)-3,4-dihydroxy-6-methyl-5-[[(1s,4r,5s,6s)-4,5,6-trihydroxy-3-(hydroxymethyl)-1-cyclohex-2-enyl]amino]tetrahydropyran-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-6-(hydroxymethyl)tetrahydropyran-2,3,4-triol
  • (2r,3r,4r,5s,6r)-5-[(2r,3r,4r,5s,6r)-5-[(2r,3r,4s,5s,6r)-3,4-dihydroxy-6-methyl-5-[[(1s,4r,5s,6s)-4,5,6-trihydroxy-3-methylol-1-cyclohex-2-enyl]amino]tetrahydropyran-2-yl]oxy-3,4-dihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-6-methylol-tetrahydropyran-2,3,4-triol
  • (2r,3r,4r,5s,6r)-5-[[(2r,3r,4r,5s,6r)-5-[[(2r,3r,4s,5s,6r)-3,4-dihydroxy-6-methyl-5-[[(1s,4r,5s,6s)-4,5,6-trihydroxy-3-(hydroxymethyl)-1-cyclohex-2-enyl]amino]-2-tetrahydropyranyl]oxy]-3,4-dihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-6-(hydroxymethyl)tetrahydropyran-2,3,4-triol
  • aci-(1-4)gld-(1-4)glc-(1-4)glb
  • bay-g-5421
  • glucor
  • hmc-(1-4)agl-(1-4)glc-(1-4)glc
  • prandase
InChIKey XUFXOAAUWZOOIT-SXARVLRPSA-N
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