TL;DR: Syzygiol (CAS 133056-30-1) is a chemical compound with molecular formula C18H18O5 and molecular weight 314.11542 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-hydroxy-2-[(Z)-3-hydroxy-3-phenylprop-2-enoyl]-5-methoxy-6,6-dimethylcyclohexa-2,4-dien-1-one
Also Known As: Syzygiol, 3-hydroxy-2-[(Z)-3-hydroxy-3-phenylprop-2-enoyl]-5-methoxy-6,6-dimethylcyclohexa-2,4-dien-1-one, (Z)-3-Hydroxy-1-(2-hydroxy-4-methoxy-5,5-dimethyl-6-oxo-1,3-cyclohexadien-1-yl)-3-phenyl-2-propen-1-one, 3-hydroxy-2-((Z)-3-hydroxy-3-phenylprop-2-enoyl)-5-methoxy-6,6-dimethylcyclohexa-2,4-dien-1-one, 3-hydroxy-2-[(2Z)-3-hydroxy-3-phenylprop-2-enoyl]-5-methoxy-6,6-dimethylcyclohexa-2,4-dien-1-one
| Molecular Formula | C18H18O5 |
| Molecular Weight | 314.11542 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 314.11542 Da |
| Heavy Atoms | 23 |
| Complexity | 601.0 |
| SMILES | CC1(C(=CC(=C(C1=O)C(=O)/C=C(/C2=CC=CC=C2)\O)O)OC)C |
| InChIKey | GVAQGCYXZYJWML-XFXZXTDPSA-N |
The XLogP value of 3.0 indicates that Syzygiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Syzygiol. Following Lipinski's Rule of Five, Syzygiol has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Syzygiol is 133056-30-1.
The molecular formula of Syzygiol is C18H18O5.
The molecular weight of Syzygiol is 314.11542 g/mol.
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