Garcimangosone D

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Properties Simple | Detailed

Formula C19H20O9
IUPAC Name [2,4-dihydroxy-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-phenyl]-phenyl-methanone
Molecular Mass 392.357 g·mol−1
Heat of Formation -1420.3 ± 16.7 kJ·mol−1
Dipole Moment 1.96 ± 1.08 D
Volume 427.36 Å 3
Surface Area 334.94 Å 2
HOMO Energy -9.48 ± 0.55 eV
LUMO Energy 2.43 ± eV
Point Group Symmetry C1
Synonyms
  • [2,4-dihydroxy-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-phenyl]-phenyl-methanone
  • [2,4-dihydroxy-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-phenylmethanone
  • [2,4-dihydroxy-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-phenyl]-phenyl-methanone
  • [2,4-dihydroxy-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-phenyl]-phenyl-methanone
  • [2,4-dihydroxy-6-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]phenyl]-phenylmethanone
InChIKey CCXXIROIENJKKR-LQDZTQBFSA-N
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