TL;DR: Schizandrer A (CAS 129445-43-8) is a chemical compound with molecular formula C30H32O9 and molecular weight 536.20465 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(8R,9R,10S)-9-hydroxy-3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-8-yl] benzoate
Also Known As: Benzoylgomisin P, Schizandrer A, Schisantherin A, Gomisin C, PC315 cpd
| Molecular Formula | C30H32O9 |
| Molecular Weight | 536.20465 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 536.20465 Da |
| Heavy Atoms | 39 |
| Complexity | 833.0 |
| SMILES | C[C@H]1CC2=CC3=C(C(=C2C4=C(C(=C(C=C4[C@H]([C@]1(C)O)OC(=O)C5=CC=CC=C5)OC)OC)OC)OC)OCO3 |
| InChIKey | UFCGDBKFOKKVAC-HYSLPFRTSA-N |
The XLogP value of 5.0 indicates that Schizandrer A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Schizandrer A. Following Lipinski's Rule of Five, Schizandrer A has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Schizandrer A is 129445-43-8.
The molecular formula of Schizandrer A is C30H32O9.
The molecular weight of Schizandrer A is 536.20465 g/mol.
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