Difucosyllactose

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Properties Simple | Detailed

Formula C24H42O19
IUPAC Name (2r,3s,4r,5r)-2-[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-4,5,6-trihydroxy-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-hexanal
Molecular Mass 634.579 g·mol−1
Heat of Formation -3542.6 ± 16.7 kJ·mol−1
Dipole Moment 8.97 ± 1.08 D
Volume 704.75 Å 3
Surface Area 496.71 Å 2
HOMO Energy -9.83 ± 0.55 eV
LUMO Energy -0.09 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s,4r,5r)-2-[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-oxan-2-yl]oxy-4,5,6-trihydroxy-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-hexanal
  • (2r,3s,4r,5r)-2-[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-4,5,6-trihydroxy-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-hexanal
  • (2r,3s,4r,5r)-2-[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-4,5,6-trihydroxy-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyhexanal
  • (2r,3s,4r,5r)-2-[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-methylol-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-4,5,6-trihydroxy-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-hexanal
  • (2r,3s,4r,5r)-2-[[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-[[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl]oxy]-2-tetrahydropyranyl]oxy]-4,5,6-trihydroxy-3-[[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl]oxy]hexanal
  • 3,2'-difucosyllactose
  • 3,2'-dl
  • d-glucose, o-6-deoxy-alpha-l-galactopyranosyl-(1-3)-o-(o-6-deoxy-alpha-l-galactopyranosyl-(1-2)-beta-d-galactopyranosyl-(1-4))-
CAS Number(s)
  • 14463-37-7
  • 20768-11-0
  • 41312-51-0
  • 76472-94-1
InChIKey BRHHWBDLMUBZQQ-JZEMXWCPSA-N
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