(13S,14R,15R)-13-(4-Benzoyl-3,5-Dihydroxyphenoxy)-2,3,4,5,6,7,14,15-Octahydroxy-11,11A,13,14,15,15A-Hexahydrodibenzo[G,I]Pyrano[3,2-B][1,5]Dioxacycloundecine-9,17-Dione

Molecule SVG Image

Properties Simple | Detailed

Formula C33H10O17
IUPAC Name (13s,14r,15r)-13-(4-benzoyl-3,5-dihydroxyphenoxy)-2,3,4,5,6,7,14,15-octahydroxy-11,11a,13,14,15,15a-hexahydrodibenzo[g,i]pyrano[3,2-b][1,5]dioxacycloundecine-9,17-dione
Molecular Mass 678.422 g·mol−1
Heat of Formation -246.7 ± 16.7 kJ·mol−1
Dipole Moment 17.58 ± 1.08 D
Volume 611.25 Å 3
Surface Area 470.82 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -3.80 ± eV
Point Group Symmetry C1
InChIKey RPZNIDVYYGUDPA-CISBKVEVSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C O