Mallotojaponin C

Molecule SVG Image

Properties Simple | Detailed

Formula C29H36O8
IUPAC Name 1-[3-[[3-acetyl-2,4-dihydroxy-6-methoxy-5-(3-methylbut-2-enyl)phenyl]methyl]-2,6-dihydroxy-4-methoxy-5-(3-methylbut-2-enyl)phenyl]ethanone
Molecular Mass 512.591 g·mol−1
Heat of Formation -1452.4 ± 16.7 kJ·mol−1
Dipole Moment 6.22 ± 1.08 D
Volume 614.13 Å 3
Surface Area 433.09 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy 2.24 ± eV
Point Group Symmetry C1
InChIKey SQDDGCHCPZMCOU-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O