Methyl 5-{5-Hydroxy-4-[(1E)-3-Hydroxy-3-(4-Propylcyclohexyl)-1-Propen-1-Yl]-3,3A,4,5,6,6A-Hexahydrocyclopenta[B]Pyrrol-2-Yl}Pentanoate

Molecule SVG Image

Properties Simple | Detailed

Formula C25H41NO4
IUPAC Name methyl 5-[(3as,4r,5r,6ar)-5-hydroxy-4-[(e,3s)-3-hydroxy-3-(4-propylcyclohexyl)prop-1-enyl]-3,3a,4,5,6,6a-hexahydrocyclopenta[b]pyrrol-2-yl]pentanoate
Molecular Mass 419.597 g·mol−1
Heat of Formation -921.0 ± 16.7 kJ·mol−1
Dipole Moment 3.87 ± 1.08 D
Volume 552.26 Å 3
Surface Area 418.08 Å 2
HOMO Energy -9.79 ± 0.55 eV
LUMO Energy 0.82 ± eV
Point Group Symmetry C1
InChIKey UQEOPLABKYFAJH-SFYUYAQISA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N