TL;DR: 5-(tetra-O-benzyl-alpha-glucopyranosyl)-1,3-pentadiene (CAS 125365-10-8) is a chemical compound with molecular formula C39H42O5 and molecular weight 590.3032 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R,3R,4R,5S,6R)-5-[(2-benzylphenyl)methoxy]-6-[(2E)-penta-2,4-dienyl]-3,4-bis(phenylmethoxy)oxan-2-yl]methanol
Also Known As: Tetrabenzyl-glu-pentadiene, 5-(Tetra-O-benzyl-alpha-glucopyranosyl)-1,3-pentadiene, [(2R,3R,4R,5S,6R)-5-[(2-benzylphenyl)methoxy]-6-[(2E)-penta-2,4-dienyl]-3,4-bis(phenylmethoxy)oxan-2-yl]methanol
| Molecular Formula | C39H42O5 |
| Molecular Weight | 590.3032 g/mol |
| XLogP | 7.2 |
| Topological Polar Surface Area (TPSA) | 57.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Exact Mass | 590.3032 Da |
| Heavy Atoms | 44 |
| Complexity | 811.0 |
| SMILES | C=C/C=C/C[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)OCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4CC5=CC=CC=C5 |
| InChIKey | FJEYHLHWDHWCGC-AWGAJALQSA-N |
The XLogP value of 7.2 indicates that 5-(tetra-O-benzyl-alpha-glucopyranosyl)-1,3-pentadiene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.2 Ų, 5-(tetra-O-benzyl-alpha-glucopyranosyl)-1,3-pentadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(tetra-O-benzyl-alpha-glucopyranosyl)-1,3-pentadiene has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 5-(tetra-O-benzyl-alpha-glucopyranosyl)-1,3-pentadiene is 125365-10-8.
The molecular formula of 5-(tetra-O-benzyl-alpha-glucopyranosyl)-1,3-pentadiene is C39H42O5.
The molecular weight of 5-(tetra-O-benzyl-alpha-glucopyranosyl)-1,3-pentadiene is 590.3032 g/mol.
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