4-Hydroxyphenyl 6-O-[(2-Aminoethoxy)(Hydroxy)Phosphoryl]-β-D-Glucopyranoside

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Formula C14H22NO10P
IUPAC Name 2-aminoethyl [(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)tetrahydropyran-2-yl]methyl hydrogen phosphate
Molecular Mass 395.299 g·mol−1
Heat of Formation -2004.0 ± 16.7 kJ·mol−1
Dipole Moment 4.97 ± 1.08 D
Volume 425.55 Å 3
Surface Area 338.65 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy -0.18 ± eV
Point Group Symmetry C1
Synonyms
  • 2-aminoethyl [(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)-2-tetrahydropyranyl]methyl hydrogen phosphate
  • 2-aminoethyl [(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)oxan-2-yl]methyl hydrogen phosphate
  • 2-aminoethyl [(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)tetrahydropyran-2-yl]methyl hydrogen phosphate
  • 4-hydroxyphenyl-o-beta-d-glucose-6-phosphoethanolamine
  • arbutin-6-phosphoethanolamine
  • arbutin-p-ethanolamine
CAS Number(s)
  • 123723-74-0
InChIKey IGFCORNRSYFBFT-RKQHYHRCSA-N
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