Delphinidin 3,3',5'-tri-O-glucoside
TL;DR: Delphinidin 3,3',5'-tri-O-glucoside (CAS 132548-17-5) is a chemical compound with molecular formula C33H41O22+ and molecular weight 789.2089 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3R,4S,5S,6R)-2-[5-[5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-2-yl]-2-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Delphinidin 3,3',5'-tri-O-glucoside, (2S,3R,4S,5S,6R)-2-[5-[5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-2-yl]-2-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol, (2S,3R,4S,5R,6R)-2-[5-[5,7-dihydroxy-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-chromen-2-yl]-2-hydroxy-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol, (2S,3R,4S,5S,6R)-2-[5-[5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromenylium-2-yl]-2-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-phenoxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol, 2-[3,5-Bis(beta-D-glucopyranosyloxy)-4-hydroxyphenyl]-3-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-1-benzopyrylium
Technical Specifications
| Molecular Formula | C33H41O22+ |
| Molecular Weight | 789.2089 g/mol |
| XLogP | -4.9662 |
| Topological Polar Surface Area (TPSA) | 360.0 Ų |
| Hydrogen Bond Donors | 15 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 10 |
| Exact Mass | 789.2089 Da |
| Heavy Atoms | 55 |
| Complexity | 1170.0 |
| SMILES | C1=C(C=C(C(=C1O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C4=[O+]C5=CC(=CC(=C5C=C4O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)O |
| InChIKey | QLGDRYVFMZAWDU-KCRRSQHJSA-O |
Chemical Property Profile of Delphinidin 3,3',5'-tri-O-glucoside
Property Insights of Delphinidin 3,3',5'-tri-O-glucoside
The XLogP value of -4.9662 indicates that Delphinidin 3,3',5'-tri-O-glucoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 360.0 Ų indicates high polarity, suggesting Delphinidin 3,3',5'-tri-O-glucoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Delphinidin 3,3',5'-tri-O-glucoside has 15 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Delphinidin 3,3',5'-tri-O-glucoside?
The CAS number of Delphinidin 3,3',5'-tri-O-glucoside is 132548-17-5.
What is the molecular formula of Delphinidin 3,3',5'-tri-O-glucoside?
The molecular formula of Delphinidin 3,3',5'-tri-O-glucoside is C33H41O22+.
What is the molecular weight of Delphinidin 3,3',5'-tri-O-glucoside?
The molecular weight of Delphinidin 3,3',5'-tri-O-glucoside is 789.2089 g/mol.
Where can I buy Delphinidin 3,3',5'-tri-O-glucoside?
You can request a quote for Delphinidin 3,3',5'-tri-O-glucoside directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Delphinidin 3,3',5'-tri-O-glucoside?
Yes, CoreyChem provides custom synthesis services for Delphinidin 3,3',5'-tri-O-glucoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.