Rhodoxanthin

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Properties Simple | Detailed

Formula C40H50O2
IUPAC Name 3,4-dimethylene-2-[(2-prop-1-ynylcyclopropylidene)methylene]bicyclo[4.1.0]hept-1(6)-en-5-one; 8-[2-(2-methylcyclopropen-1-yl)ethynyl]-7-methylene-spiro[2.5]octan-5-one
Molecular Mass 562.824 g·mol−1
Heat of Formation 12.0 ± 16.7 kJ·mol−1
Dipole Moment 0.66 ± 1.08 D
Volume 778.33 Å 3
Surface Area 658.86 Å 2
HOMO Energy -8.37 ± 0.55 eV
LUMO Energy -1.16 ± eV
Point Group Symmetry C2
Synonyms
  • (4e)-3,5,5-trimethyl-4-[(2e,4e,6e,8e,10e,12e,14e,16e,18e)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-4-oxo-1-cyclohex-2-enylidene)octadeca-2,4,6,8,10,12,14,16-octaenylidene]-1-cyclohex-2-enone
  • (4e)-3,5,5-trimethyl-4-[(2e,4e,6e,8e,10e,12e,14e,16e,18e)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-4-oxo-1-cyclohex-2-enylidene)octadeca-2,4,6,8,10,12,14,16-octaenylidene]cyclohex-2-en-1-one
  • (4e)-4-[(2e,4e,6e,8e,10e,12e,14e,16e,18e)-18-(4-keto-2,6,6-trimethyl-1-cyclohex-2-enylidene)-3,7,12,16-tetramethyl-octadeca-2,4,6,8,10,12,14,16-octaenylidene]-3,5,5-trimethyl-cyclohex-2-en-1-one
  • 4,5'-retro-beta,beta-carotene-3,3'-dione, 4',5'-didehydro-
  • lmpr01070280
CAS Number(s)
  • 2231-40-5
  • 116-30-3
InChIKey VWXMLZQUDPCJPL-ZDHAIZATSA-N
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