4-Methyl-2-Oxo-2H-Chromen-7-Yl α-D-Mannopyranoside

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Properties Simple | Detailed

Formula C16H19O8+
IUPAC Name 4-methyl-7-[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-2-one
Molecular Mass 339.317 g·mol−1
Heat of Formation -1306.7 ± 16.7 kJ·mol−1
Dipole Moment 4.82 ± 1.08 D
Volume 370.42 Å 3
Surface Area 325.64 Å 2
HOMO Energy -9.42 ± 0.55 eV
LUMO Energy -1.10 ± eV
Point Group Symmetry C1
Synonyms
  • 4-methyl-7-[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-chromen-2-one
  • 4-methyl-7-[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
  • 4-methyl-7-[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-2-one
  • 4-methyl-7-[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-coumarin
  • 4-methyl-7-[[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-chromenone
  • 4-methylumbelliferyl alpha-d-mannopyranoside
InChIKey YUDPTGPSBJVHCN-VMMWWAARSA-N
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