4-Hydroxy-2-Isopropyl-5-Methylphenyl 6-O-(3,4,5-Trihydroxybenzoyl)-β-D-Glucopyranoside
Properties
Property | Value |
---|---|
Formula | C23H28O11 |
IUPAC Name | [(2r,3s,4s,5s,6s)-3,4,5-trihydroxy-6-(4-hydroxy-2-isopropyl-5-methyl-phenoxy)tetrahydropyran-2-yl]methyl 3,4,5-trihydroxybenzoate |
Molecular Mass | 480.462 g·mol−1 |
Heat of Formation | -1906.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.52 ± 1.08 D |
Volume | 540.95 Å 3 |
Surface Area | 410.24 Å 2 |
HOMO Energy | -8.91 ± 0.55 eV |
LUMO Energy | 2.53 ± eV |
Point Group Symmetry | C1 |
InChIKey | HIQCPXXJKQKGEJ-ZNCFPDGUSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |