(3S,4S)-6-{(E)-2-[(1R,3S)-1,3-Dimethyl-4-Oxocyclohexyl]Vinyl}-4,5-Dihydroxy-3-Methoxy-4-Phenyl-3,4-Dihydro-2(1H)-Quinolinone

Molecule SVG Image

Properties Simple | Detailed

Formula C26H29NO5
IUPAC Name (3s,4s)-6-[(e)-2-[(1r,3s)-1,3-dimethyl-4-oxo-cyclohexyl]vinyl]-4,5-dihydroxy-3-methoxy-4-phenyl-1,3-dihydroquinolin-2-one
Molecular Mass 435.512 g·mol−1
Heat of Formation -719.8 ± 16.7 kJ·mol−1
Dipole Moment 3.92 ± 1.08 D
Volume 525.95 Å 3
Surface Area 425.63 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy 2.38 ± eV
Point Group Symmetry C1
InChIKey QWVOGENNJWSIPL-KRLQRQCXSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N