(6S)-1,6:2,5-Dianhydro-2-(Carboxymethyl)-3,4-Dideoxy-6-(5-Hydroxy-4,8-Dimethyl-7-Nonen-1-Yl)-6-Methyl-D-Erythro-Hexitol

Molecule SVG Image

Properties Simple | Detailed

Formula C20H34O5
IUPAC Name 2-[(1r,2r,5r)-2-[(4r,5r)-5-hydroxy-4,8-dimethyl-non-7-enyl]-2-methyl-3,8-dioxabicyclo[3.2.1]octan-5-yl]acetic acid
Molecular Mass 354.481 g·mol−1
Heat of Formation -1132.5 ± 16.7 kJ·mol−1
Dipole Moment 4.13 ± 1.08 D
Volume 463.69 Å 3
Surface Area 363.48 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy 0.76 ± eV
Point Group Symmetry C1
InChIKey WOPYURXQWMHYFG-UNNPPQAFSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O