3-Hydroxy-2-[3-(4-Hydroxyphenyl)Propanoyl]-5-Methoxyphenyl β-D-Glucopyranoside

Molecule SVG Image

Properties Simple | Detailed

Formula C22H26O10
IUPAC Name 1-[2-hydroxy-4-methoxy-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-phenyl]-3-(4-hydroxyphenyl)propan-1-one
Molecular Mass 450.436 g·mol−1
Heat of Formation -1657.9 ± 16.7 kJ·mol−1
Dipole Moment 5.45 ± 1.08 D
Volume 514.62 Å 3
Surface Area 385.15 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -0.15 ± eV
Point Group Symmetry C1
InChIKey PQCIBORQLVRFMR-MIUGBVLSSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O