5-Hydroxy-2-(4-Hydroxy-3-Methoxyphenyl)-7-Methoxy-4-Oxo-4H-Chromen-3-Yl 6-O-(4-Carboxy-3-Hydroxy-3-Methylbutanoyl)Hexopyranoside
Properties
Property | Value |
---|---|
Formula | C29H32O16 |
IUPAC Name | (3r)-3-hydroxy-3-methyl-5-oxo-5-[[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-7-methoxy-4-oxo-chromen-3-yl]oxy-tetrahydropyran-2-yl]methoxy]pentanoic acid |
Molecular Mass | 636.555 g·mol−1 |
Heat of Formation | -2691.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.43 ± 1.08 D |
Volume | 679.59 Å 3 |
Surface Area | 527.82 Å 2 |
HOMO Energy | -9.03 ± 0.55 eV |
LUMO Energy | 1.86 ± eV |
Point Group Symmetry | C1 |
InChIKey | ZPMHWGODKDJELN-BIMZHHFASA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |