(1R,2S,3S,7R,8S,9R,13S)-2,7-Dimethyl-8-{[(2Z)-2-Methyl-2-Butenoyl]Oxy}-10-Methylene-6,11-Dioxotricyclo[7.3.1.0~3,7~]Tridec-4-En-13-Yl 3-Hydroxy-3-Methylpentanoate

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Properties Simple | Detailed

Formula C27H36O7
IUPAC Name [2,7-dimethyl-8-[(z)-2-methylbut-2-enoyl]oxy-10-methylene-6,11-dioxo-13-tricyclo[7.3.1.03,7]tridec-4-enyl] 3-hydroxy-3-methyl-pentanoate
Molecular Mass 472.571 g·mol−1
Heat of Formation -920.3 ± 16.7 kJ·mol−1
Dipole Moment 1.44 ± 1.08 D
Volume 576.02 Å 3
Surface Area 425.78 Å 2
HOMO Energy -9.70 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
InChIKey GITLLTFFMVJTME-DQSLZJRMSA-N
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