3,5,9-Trihydroxy-8-Methoxy-2,2-Dimethyl-7-(3-Methyl-2-Buten-1-Yl)-3,4-Dihydro-2H,6H-Pyrano[3,2-B]Xanthen-6-One

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Properties Simple | Detailed

Formula C24H26O7
IUPAC Name (3r)-3,5,9-trihydroxy-8-methoxy-2,2-dimethyl-7-(3-methylbut-2-enyl)-3,4-dihydropyrano[3,2-b]xanthen-6-one
Molecular Mass 426.459 g·mol−1
Heat of Formation -1136.1 ± 16.7 kJ·mol−1
Dipole Moment 3.76 ± 1.08 D
Volume 483.94 Å 3
Surface Area 407.07 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy -0.81 ± eV
Point Group Symmetry C1
InChIKey KCMPFWGUVNEDHW-GOSISDBHSA-N
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