6-Cyclohexyl-2-(4-Cyclohexylbutyl)-2-({[4-O-(α-D-Glucopyranosyl)-Beta-D-Glucopyranosyl]Oxy}Methyl)Hexyl 4-O-α-D-Glucopyranosyl-Beta-D-Glucopyranoside
Properties
Property | Value |
---|---|
Formula | C47H84O22 |
IUPAC Name | (2r,3r,4s,5s,6r)-2-[(2r,3s,4r,5r,6r)-6-[6-cyclohexyl-2-(4-cyclohexylbutyl)-2-[[(2r,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxymethyl]hexoxy]-4,5-dihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol |
Molecular Mass | 1001.157 g·mol−1 |
Heat of Formation | -4467.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.56 ± 1.08 D |
Volume | 1211.98 Å 3 |
Surface Area | 933.92 Å 2 |
HOMO Energy | -10.46 ± 0.55 eV |
LUMO Energy | 0.82 ± eV |
Point Group Symmetry | C1 |
InChIKey | IBVSQWFQEONEKZ-VWHTXWAPSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |