Chitotriose

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Properties Simple | Detailed

Formula C18H35N3O13
IUPAC Name (2r,3r,4s,5r)-2-amino-4-[(2s,3r,4r,5s,6r)-3-amino-5-[(2s,3r,4r,5s,6r)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-3,5,6-trihydroxy-hexanal
Molecular Mass 501.483 g·mol−1
Heat of Formation -2373.7 ± 16.7 kJ·mol−1
Dipole Moment 5.84 ± 1.08 D
Volume 559.07 Å 3
Surface Area 450.95 Å 2
HOMO Energy -9.48 ± 0.55 eV
LUMO Energy 3.63 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r)-2-amino-4-[(2s,3r,4r,5s,6r)-3-amino-5-[(2s,3r,4r,5s,6r)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5,6-trihydroxy-hexanal
  • (2r,3r,4s,5r)-2-amino-4-[(2s,3r,4r,5s,6r)-3-amino-5-[(2s,3r,4r,5s,6r)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5,6-trihydroxyhexanal
  • (2r,3r,4s,5r)-2-amino-4-[(2s,3r,4r,5s,6r)-3-amino-5-[(2s,3r,4r,5s,6r)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-3,5,6-trihydroxy-hexanal
  • (2r,3r,4s,5r)-2-amino-4-[(2s,3r,4r,5s,6r)-3-amino-5-[(2s,3r,4r,5s,6r)-3-amino-4,5-dihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-4-hydroxy-6-methylol-tetrahydropyran-2-yl]oxy-3,5,6-trihydroxy-hexanal
  • (2r,3r,4s,5r)-2-amino-4-[[(2s,3r,4r,5s,6r)-3-amino-5-[[(2s,3r,4r,5s,6r)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-4-hydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-3,5,6-trihydroxyhexanal
  • chitintriose
  • chitotrisaccharide
  • d-glucose, o-2-amino-2-deoxy-beta-d-glucopyranosyl-(1-4)-o-2-amino-2-deoxy-beta-d-glucopyranosyl-(1-4)-2-amino-2-deoxy-
CAS Number(s)
  • 41708-93-4
InChIKey HBAVVSYNWHLVDB-UDAFUQIYSA-N
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