[8-Acetoxy-12-Hydroxy-2-(2-Methyl-3-Propyl-2-Oxiranyl)-4,11-Dioxo-8,9,10,11-Tetrahydro-4H-Naphtho[2,3-H]Chromen-5-Yl]Acetic Acid

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Properties Simple | Detailed

Formula C27H27O9+
IUPAC Name 2-[(8s)-8-acetoxy-12-hydroxy-2-[(2r,3s)-2-methyl-3-propyl-oxiran-2-yl]-4,11-dioxo-9,10-dihydro-8h-naphtho[2,3-h]chromen-5-yl]acetic acid
Molecular Mass 495.498 g·mol−1
Heat of Formation -1396.7 ± 16.7 kJ·mol−1
Dipole Moment 5.44 ± 1.08 D
Volume 557.3 Å 3
Surface Area 465.98 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -1.36 ± eV
Point Group Symmetry C1
InChIKey UILRBVIPTXHVIG-RWYJCYHVSA-N
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