Methyl (5Z)-7-{(1R,2R,3R,5S)-3,5-Dihydroxy-2-[(1E)-3-Hydroxy-3-Methyl-5-Phenyl-1-Penten-1-Yl]Cyclopentyl}-5-Heptenoate

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Properties Simple | Detailed

Formula C25H36O5
IUPAC Name methyl (z)-7-[(1r,2r,3r,5s)-3,5-dihydroxy-2-[(e,3r)-3-hydroxy-3-methyl-5-phenyl-pent-1-enyl]cyclopentyl]hept-5-enoate
Molecular Mass 416.550 g·mol−1
Heat of Formation -977.3 ± 16.7 kJ·mol−1
Dipole Moment 4.44 ± 1.08 D
Volume 547.47 Å 3
Surface Area 396.71 Å 2
HOMO Energy -9.48 ± 0.55 eV
LUMO Energy 0.23 ± eV
Point Group Symmetry C1
InChIKey VNLSHURFDKMJSN-ZNKBCCKYSA-N
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Elements H C O