1-[(2R,3S)-2-[(3E)-4,8-Dimethyl-3,7-Nonadien-1-Yl]-5,7-Dihydroxy-2-Methyl-3-(3-Methyl-2-Buten-1-Yl)-3,4-Dihydro-2H-Chromen-8-Yl]-2-Methyl-1-Butanone

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Properties Simple | Detailed

Formula C31H46O4
IUPAC Name (2r)-1-[(2r,3s)-2-[(3e)-4,8-dimethylnona-3,7-dienyl]-5,7-dihydroxy-2-methyl-3-(3-methylbut-2-enyl)chroman-8-yl]-2-methyl-butan-1-one
Molecular Mass 482.695 g·mol−1
Heat of Formation -900.5 ± 16.7 kJ·mol−1
Dipole Moment 4.27 ± 1.08 D
Volume 658.68 Å 3
Surface Area 474.38 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy 0.23 ± eV
Point Group Symmetry C1
InChIKey KNWRSKBHVUABNU-GEPYNVQKSA-N
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Elements H C O