(-)-Gambogic Acid

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Formula C38H44O8
IUPAC Name (2z)-4-[(2s,8r,17s,19r)-12-hydroxy-8,21,21-trimethyl-5-(3-methyl-2-buten-1-yl)-8-(4-methyl-3-penten-1-yl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.0 2,15 .0 2,19 .0 4,13 .0 6,11 ]docosa-4(13),5,9,11,15-pentaen-19-yl]-2-methyl-2-butenoic acid
Molecular Mass 628.751 g·mol−1
Heat of Formation -1315.0 ± 16.7 kJ·mol−1
Dipole Moment 6.88 ± 1.08 D
Volume 747.78 Å 3
Surface Area 548.92 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy -1.09 ± eV
Point Group Symmetry C1
InChIKey GEZHEQNLKAOMCA-YKALZJHMSA-N
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Elements H C O