4-[(3R)-7-Hydroxy-5-Methoxy-6-(3-Methyl-2-Buten-1-Yl)-3,4-Dihydro-2H-Chromen-3-Yl]-2-(3-Methyl-2-Buten-1-Yl)-1,3-Benzenediol

Molecule SVG Image

Properties Simple | Detailed

Formula C26H32O5
IUPAC Name 4-[(3r)-7-hydroxy-5-methoxy-6-(3-methylbut-2-enyl)chroman-3-yl]-2-(3-methylbut-2-enyl)benzene-1,3-diol
Molecular Mass 424.529 g·mol−1
Heat of Formation -807.1 ± 16.7 kJ·mol−1
Dipole Moment 3.44 ± 1.08 D
Volume 526.58 Å 3
Surface Area 454.83 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy 0.03 ± eV
Point Group Symmetry C1
Synonyms
  • 4-((r)-7-hydroxy-5-methoxy-6-(3-methyl-but-2-enyl)-1-benzopyran-3-yl)-2-((e)-3-methyl-but-2-enyl)-benzene-1,3-diol
  • 4-[(3r)-7-hydroxy-5-methoxy-6-(3-methylbut-2-enyl)-3-chromanyl]-2-(3-methylbut-2-enyl)benzene-1,3-diol
  • 4-[(3r)-7-hydroxy-5-methoxy-6-(3-methylbut-2-enyl)chroman-3-yl]-2-(3-methylbut-2-enyl)benzene-1,3-diol
  • 4-[(3r)-7-hydroxy-5-methoxy-6-(3-methylbut-2-enyl)chroman-3-yl]-2-(3-methylbut-2-enyl)resorcinol
  • 4-[(r)-7-hydroxy-5-methoxy-6-(3-methyl-but-2-enyl)-1-benzopyran-3-yl]-2-((e)-3-methyl-but-2-enyl)-benzene-1,3-diol
  • licoricidin
CAS Number(s)
  • 30508-27-1
InChIKey GBRZTUJCDFSIHM-KRWDZBQOSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O