(3S)-12-Hydroxy-14-Methoxy-3-Methyl-3,4,5,6,7,8,9,10-Octahydro-1H-2-Benzoxacyclododecin-1-One

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Properties Simple | Detailed

Formula C17H24O4
IUPAC Name (9s)-15-hydroxy-13-methoxy-9-methyl-10-oxabicyclo[10.4.0]hexadeca-1(12),13,15-trien-11-one
Molecular Mass 292.370 g·mol−1
Heat of Formation -777.7 ± 16.7 kJ·mol−1
Dipole Moment 2.37 ± 1.08 D
Volume 362.63 Å 3
Surface Area 294.44 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy -0.03 ± eV
Point Group Symmetry C1
InChIKey OKWRDLQBKAOJNC-LBPRGKRZSA-N
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Elements H C O