Methyl [(4As,4Br,5S,6As,6Bs,9Ar,10As,10Bs)-4B-Fluoro-5-Hydroxy-4A,6A,8,8-Tetramethyl-2-Oxo-2,4A,4B,5,6,6A,9A,10,10A,10B,11,12-Dodecahydro-6Bh-Naphtho[2',1':4,5]Indeno[1,2-D][1,3]Dioxol-6B-Yl](Oxo)Acetate

Molecule SVG Image

Properties Simple | Detailed

Formula C25H31FO7
IUPAC Name methyl 2-[(1s,2s,4s,8s,9s,11s,12r,13s)-12-fluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxo-acetate
Molecular Mass 462.508 g·mol−1
Heat of Formation -1226.3 ± 16.7 kJ·mol−1
Dipole Moment 6.95 ± 1.08 D
Volume 523.53 Å 3
Surface Area 395.08 Å 2
HOMO Energy -9.75 ± 0.55 eV
LUMO Energy -0.36 ± eV
Point Group Symmetry C1
InChIKey MDMRGBNICACKDW-RYEAKIFOSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O F