Methyl [(1S,3R,4S,7R,8S,9S,11S,14S,17R,26S)-4,9,11,19,19-Pentamethyl-5,10,21,24-Tetraoxo-2,6,18,25-Tetraoxaheptacyclo[12.10.1.1~1,8~.0~3,7~.0~11,26~.0~14,23~.0~16,20~]Hexacosa-16(20),22-Dien-17-Yl]Acetate

Molecule SVG Image

Properties Simple | Detailed

Formula C30H34O10
IUPAC Name methyl [(1s,3r,4s,7r,8s,9s,11s,14s,17r,26s)-4,9,11,19,19-pentamethyl-5,10,21,24-tetraoxo-2,6,18,25-tetraoxaheptacyclo[12.10.1.1 1,8 .0 3,7 .0 11,26 .0 14,23 .0 16,20 ]hexacosa-16(20),22-dien-17-yl]acetate
Molecular Mass 554.585 g·mol−1
Heat of Formation -1657.6 ± 16.7 kJ·mol−1
Dipole Moment 5.03 ± 1.08 D
Volume 626.79 Å 3
Surface Area 476.8 Å 2
HOMO Energy -9.97 ± 0.55 eV
LUMO Energy -1.54 ± eV
Point Group Symmetry C1
InChIKey SJNBDGQEQVFVTG-ZGWHAFSYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O