3-Hydroxy-2-[(2E)-3-(2-Hydroxyphenyl)-2-Propenoyl]-5-Methoxyphenyl β-D-Threo-Hexopyranoside

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Properties Simple | Detailed

Formula C22H24O10
IUPAC Name (e)-1-[2-hydroxy-4-methoxy-6-[(2s,4s,5s)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-phenyl]-3-(2-hydroxyphenyl)prop-2-en-1-one
Molecular Mass 448.420 g·mol−1
Heat of Formation 1394.6 ± 16.7 kJ·mol−1
Dipole Moment 2.03 ± 1.08 D
Volume 443.83 Å 3
Surface Area 349.07 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy -3.87 ± eV
Point Group Symmetry C1
InChIKey DBDVNEPYCHFXLY-HCXJNEMWSA-N
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Elements C O