2-(3-Hydroxy-4-Methoxyphenyl)Ethyl 3-O-(6-Deoxy-α-D-Mannopyranosyl)-4-O-[(2E)-3-(4-Hydroxy-3-Methoxyphenyl)-2-Propenoyl]-Beta-D-Glucopyranoside

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Properties Simple | Detailed

Formula C31H40O15
IUPAC Name 4-(6-methylene-3,4,5-trioxo-tetrahydropyran-2-yl)oxy-6-(oxomethylene)tetrahydropyran-2,3,5-trione; molecular oxygen; prop-1-yne; prop-1-yn-1-ol
Molecular Mass 652.640 g·mol−1
Heat of Formation -2496.1 ± 16.7 kJ·mol−1
Dipole Moment 4.00 ± 1.08 D
Volume 742.89 Å 3
Surface Area 627.69 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -1.02 ± eV
Point Group Symmetry C1
InChIKey WLWAYPFRKDSFCL-PMQRAQSFSA-N
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Elements H C O