2-(3,4-Dihydroxyphenyl)-2-Hydroxyethyl 6-O-(6-Deoxyhexopyranosyl)-4-O-[3-(3,4-Dihydroxyphenyl)Acryloyl]Hexopyranoside

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Properties Simple | Detailed

Formula C29H18O16
IUPAC Name methanone; 2-methylenepyran-3,4,5-trione; 5-(oxomethylene)cyclohex-3-ene-1,2-dione; 2-(oxomethylene)pyran-3,4,5-trione; (5z)-5-(3-oxoprop-2-enylidene)cyclohex-3-ene-1,2-dione
Molecular Mass 622.444 g·mol−1
Heat of Formation 845.0 ± 16.7 kJ·mol−1
Dipole Moment 11.85 ± 1.08 D
Volume 637.13 Å 3
Surface Area 533.85 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -2.53 ± eV
Point Group Symmetry C1
InChIKey IAXBXCJUSPUULA-SKYXPKOZSA-N
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