TL;DR: Hellicoside (CAS 132278-04-7) is a chemical compound with molecular formula C29H36O17 and molecular weight 656.19525 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[6-[2-(3,4-dihydroxyphenyl)-2-hydroxyethoxy]-5-hydroxy-2-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl] 3-(3,4-dihydroxyphenyl)prop-2-enoate
Also Known As: Hellicoside, [(2R,3R,4R,5R,6R)-6-[(2S)-2-(3,4-dihydroxyphenyl)-2-hydroxye, [(2R,3R,4R,5R,6R)-6-[(2S)-2-(3,4-dihydroxyphenyl)-2-hydroxyethoxy]-5-hydroxy-2-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate, [6-[2-(3,4-dihydroxyphenyl)-2-hydroxyethoxy]-5-hydroxy-2-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl] 3-(3,4-dihydroxyphenyl)prop-2-enoate
| Molecular Formula | C29H36O17 |
| Molecular Weight | 656.19525 g/mol |
| XLogP | -2.1 |
| Topological Polar Surface Area (TPSA) | 286.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 12 |
| Exact Mass | 656.19525 Da |
| Heavy Atoms | 46 |
| Complexity | 985.0 |
| SMILES | C1=CC(=C(C=C1C=CC(=O)OC2C(OC(C(C2OC3C(C(C(C(O3)CO)O)O)O)O)OCC(C4=CC(=C(C=C4)O)O)O)CO)O)O |
| InChIKey | IKASMYQBXBUEQS-UHFFFAOYSA-N |
The XLogP value of -2.1 indicates that Hellicoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 286.0 Ų indicates high polarity, suggesting Hellicoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hellicoside has 11 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Hellicoside is 132278-04-7.
The molecular formula of Hellicoside is C29H36O17.
The molecular weight of Hellicoside is 656.19525 g/mol.
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