(1R,2R,3R,4E,6E,10S,12E,14E,17R,18R)-10-[(2S)-5,7-Dihydroxy-9-Methoxy-6,8-Dimethyl-2-Decanyl]-2,17-Dihydroxy-3,5,7-Trimethyl-9,19-Dioxabicyclo[16.1.0]Nonadeca-4,6,12,14-Tetraen-8-One

Molecule SVG Image

Properties Simple | Detailed

Formula C33H54O8
IUPAC Name (1s,2r,4z,6e,9s,12z,14e,16r,17s,18s)-9-[(1r,4s,5r,6r,7s,8s)-4,6-dihydroxy-8-methoxy-1,5,7-trimethyl-nonyl]-2,17-dihydroxy-12,14,16-trimethyl-10,19-dioxabicyclo[16.1.0]nonadeca-4,6,12,14-tetraen-11-one
Molecular Mass 578.777 g·mol−1
Heat of Formation -1500.3 ± 16.7 kJ·mol−1
Dipole Moment 2.77 ± 1.08 D
Volume 776.73 Å 3
Surface Area 572.36 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy -0.26 ± eV
Point Group Symmetry C1
InChIKey VOLRALTUADVHPT-BUCMELOVSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O