Peyssonol A

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Properties Simple | Detailed

Formula C22H29BrO3
IUPAC Name 4-[[(1r,4as,6s,8ar)-6-bromo-5,5,8a-trimethyl-2-methylene-decalin-1-yl]methyl]-2,5-dihydroxy-benzaldehyde
Molecular Mass 421.368 g·mol−1
Heat of Formation -548.2 ± 16.7 kJ·mol−1
Dipole Moment 2.65 ± 1.08 D
Volume 462.08 Å 3
Surface Area 365.21 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -1.25 ± eV
Point Group Symmetry C1
Synonyms
  • 4-((6-bromodecahydro-5,5,8a-trimethyl-2-methylene-1-naphthylenyl)methyl)-2,5-dihydroxybenzaldehyde, (1alpha,4beta,6beta,8abeta)-(+)-
  • 4-[(6-bromodecahydro-5,5,8a-trimethyl-2-methylene-1-naphthylenyl)methyl]-2,5- dihydroxybenzaldehyde, (1.alpha.,4.beta.,6.beta.,8a.beta)-(+)-
  • 4-[[(1r,4as,6s,8ar)-6-bromo-5,5,8a-trimethyl-2-methylene-1-decalinyl]methyl]-2,5-dihydroxybenzaldehyde
  • 4-[[(1r,4as,6s,8ar)-6-bromo-5,5,8a-trimethyl-2-methylene-decalin-1-yl]methyl]-2,5-dihydroxy-benzaldehyde
  • 4-[[(1r,4as,6s,8ar)-6-bromo-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1h-naphthalen-1-yl]methyl]-2,5-dihydroxy-benzaldehyde
  • sesquiterpene hydroquinone
CAS Number(s)
  • 156848-67-8
InChIKey KYHAUNCXNLJHDG-ALOBAPJISA-N
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Elements H C O Br