2-(3,4-Dihydroxyphenyl)-5,7-Dihydroxy-3-{[(3E)-2,3,4,5-Tetrahydroxy-6-{[(3E)-2,3,4,5,6-Pentahydroxy-3-Hexen-1-Yl]Oxy}-3-Hexen-1-Yl]Oxy}-4H-Chromen-4-One
Properties
Property | Value |
---|---|
Formula | C27H30O17 |
IUPAC Name | 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(e,2r,5s)-2,3,4,5-tetrahydroxy-6-[(e,2s,5s)-2,3,4,5,6-pentahydroxyhex-3-enoxy]hex-3-enoxy]chromen-4-one |
Molecular Mass | 626.517 g·mol−1 |
Heat of Formation | -2748.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.29 ± 1.08 D |
Volume | 669.98 Å 3 |
Surface Area | 556.73 Å 2 |
HOMO Energy | -8.76 ± 0.55 eV |
LUMO Energy | -1.16 ± eV |
Point Group Symmetry | C1 |
InChIKey | QIAVRJHHAWLZNB-SRJIXDQKSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |