17-Dimethylaminolobohedleolide

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Formula C22H33NO4
IUPAC Name (3r,3as,6e,10z,14e,15ar)-3-[(dimethylamino)methyl]-6,14-dimethyl-2-oxo-3a,4,5,8,9,12,13,15a-octahydro-3h-cyclotetradeca[b]furan-10-carboxylic acid
Molecular Mass 375.502 g·mol−1
Heat of Formation -742.7 ± 16.7 kJ·mol−1
Dipole Moment 4.83 ± 1.08 D
Volume 492.2 Å 3
Surface Area 385.31 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy 0.26 ± eV
Point Group Symmetry C1
Synonyms
  • (3r)-3-[(dimethylamino)methyl]-6,14-dimethyl-2-oxo-3,4,5,8,9,12,13,15a,3a-nonahydrocyclotetradeca[2,1-b]furan-10-carboxylic acid
InChIKey HRPBIJBOFQXOTL-JEJSWHNFSA-N
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