(3S,4R)-4-Hydroxy-8-Methoxy-3-Methyl-3,4-Dihydro-1,7,12(2H)-Tetraphenetrione

Molecule SVG Image

Properties Simple | Detailed

Formula C20H16O5
IUPAC Name (3s,4r)-4-hydroxy-8-methoxy-3-methyl-3,4-dihydro-2h-benzo[a]anthracene-1,7,12-trione
Molecular Mass 336.338 g·mol−1
Heat of Formation -579.0 ± 16.7 kJ·mol−1
Dipole Moment 1.46 ± 1.08 D
Volume 375.0 Å 3
Surface Area 318.49 Å 2
HOMO Energy -9.79 ± 0.55 eV
LUMO Energy -1.58 ± eV
Point Group Symmetry C1
Synonyms
  • benz(a)anthracene-1,7,12(2h)-trione, 3,4-dihydro-4-hydroxy-8-methoxy-3-methyl-, trans-(+)-
  • fujianmycin b
  • ribiginone a(2)
  • rubiginone a2
  • sna 8073-a
  • sna 8073-b
CAS Number(s)
  • 96695-58-8
InChIKey MUNUJAJWLPOQBH-NIVTXAMTSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O