(2E)-1-[(5Ar,6R,9S,9As)-3,6-Dihydroxy-1-Methoxy-6-Methyl-9-Propyl-5A,6,7,8,9,9A-Hexahydrodibenzo[B,D]Furan-4-Yl]-3-Phenyl-2-Propen-1-One

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Properties Simple | Detailed

Formula C26H30O5
IUPAC Name (e)-1-[(5ar,6r,9s,9as)-3,6-dihydroxy-1-methoxy-6-methyl-9-propyl-7,8,9,9a-tetrahydro-5ah-dibenzofuran-4-yl]-3-phenyl-prop-2-en-1-one
Molecular Mass 422.513 g·mol−1
Heat of Formation -736.1 ± 16.7 kJ·mol−1
Dipole Moment 3.88 ± 1.08 D
Volume 525.08 Å 3
Surface Area 412.14 Å 2
HOMO Energy -9.01 ± 0.55 eV
LUMO Energy -0.26 ± eV
Point Group Symmetry C1
InChIKey XIYYPYFGGHPNHU-RCSCSQPYSA-N
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