Adonixanthin

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Properties Simple | Detailed

Formula C40H54O3
IUPAC Name 5-[2-(2-methylcyclopropen-1-yl)ethynyl]-3,4-dimethylene-bicyclo[4.1.0]hept-5-en-2-one; 3,4,6-trimethylene-5-[2-(2-methylenecyclopropyl)ethynyl]cyclohexane-1,2-dione
Molecular Mass 582.855 g·mol−1
Heat of Formation -327.2 ± 16.7 kJ·mol−1
Dipole Moment 3.84 ± 1.08 D
Volume 813.93 Å 3
Surface Area 686.68 Å 2
HOMO Energy -8.06 ± 0.55 eV
LUMO Energy 2.20 ± eV
Point Group Symmetry C1
Synonyms
  • (6s)-6-hydroxy-3-[(1e,3e,5e,7e,9e,11e,13e,15e,17e)-18-[(4r)-4-hydroxy-2,6,6-trimethyl-1-cyclohexenyl]-3,7,12,16-tetramethyl-octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-2,4,4-trimethyl-cyclohex-2-en-1-one
  • (6s)-6-hydroxy-3-[(1e,3e,5e,7e,9e,11e,13e,15e,17e)-18-[(4r)-4-hydroxy-2,6,6-trimethyl-1-cyclohexenyl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-2,4,4-trimethyl-1-cyclohex-2-enone
  • (6s)-6-hydroxy-3-[(1e,3e,5e,7e,9e,11e,13e,15e,17e)-18-[(4r)-4-hydroxy-2,6,6-trimethyl-1-cyclohexenyl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-2,4,4-trimethylcyclohex-2-en-1-one
  • 4-ketozeaxanthin
  • adonixanthin/ 4-ketozeaxanthin
  • lmpr01070016
InChIKey YECXHLPYMXGEBI-ZNQVSPAOSA-N
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