(1R,4S,5R,8S,11R,13R,14S,17R,18S,20R,21R,24R)-20,21-Dihydroxy-5,8,11,14,17,24-Hexamethyl-22-Oxahexacyclo[19.2.1.0~1,18~.0~4,17~.0~5,14~.0~8,13~]Tetracosane-11-Carboxylic Acid

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Formula C30H42O5
IUPAC Name (1r,4s,5r,8s,11r,13r,14s,17r,18s,20r,21r,24r)-20,21-dihydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo[19.2.1.0 1,18 .0 4,17 .0 5,14 .0 8,13 ]tetracosane-11-carboxylic acid
Molecular Mass 482.651 g·mol−1
Heat of Formation -1221.1 ± 16.7 kJ·mol−1
Dipole Moment 4.53 ± 1.08 D
Volume 596.95 Å 3
Surface Area 422.81 Å 2
HOMO Energy -9.60 ± 0.55 eV
LUMO Energy 0.83 ± eV
Point Group Symmetry C1
InChIKey JPAXVSRGFJVPEU-XCIUXINDSA-N
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