(3S,5Z,7E)-9,10-Secocholesta-5,7,10-Triene-3,20-Diol

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Formula C27H44O2
IUPAC Name (1s,3z)-3-[(2e)-2-[(1s,3as,7as)-1-[(1s)-1-hydroxy-1,5-dimethyl-hexyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methylene-cyclohexanol
Molecular Mass 400.637 g·mol−1
Heat of Formation -574.8 ± 16.7 kJ·mol−1
Dipole Moment 3.88 ± 1.08 D
Volume 550.94 Å 3
Surface Area 441.15 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy 0.37 ± eV
Point Group Symmetry C1
InChIKey IQEQEOBGZMEDBQ-LBRHRNEPSA-N
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