N-[(2S,5R,7E,9E,11R,13S)-2-Amino-5-Formyl-13-Hydroxy-4-(4-Hydroxy-3-Iodophenyl)-7,9,11-Trimethyl-3,6-Dioxo-7,9-Tetradecadien-5-Yl]-N-Methyl-L-Alaninamide

Molecule SVG Image

Properties Simple | Detailed

Formula C28H40IN3O6
IUPAC Name (2s)-2-amino-n-[(1r,3e,5e,7r,9s)-1-[(1r,3s)-3-amino-1-(4-hydroxy-3-iodo-phenyl)-2-oxo-butyl]-1-formyl-9-hydroxy-3,5,7-trimethyl-2-oxo-deca-3,5-dienyl]-n-methyl-propanamide
Molecular Mass 641.538 g·mol−1
Heat of Formation -927.1 ± 16.7 kJ·mol−1
Dipole Moment 7.11 ± 1.08 D
Volume 689.11 Å 3
Surface Area 475.77 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -0.45 ± eV
Point Group Symmetry C1
InChIKey AAHYELOHRHVDCH-HWCOUVQTSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements I H C O N