TL;DR: Piericidin B(sub 1) N-oxide (CAS 139182-76-6) is a chemical compound with molecular formula C26H39NO5 and molecular weight 445.28284 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-hydroxy-2,3-dimethoxy-6-[(2Z,5Z,7Z,9S,10S,11Z)-10-methoxy-3,7,9,11-tetramethyltrideca-2,5,7,11-tetraenyl]-5-methylpyridin-4-one
Also Known As: Piericidin B1 N-oxide, Piericidin B(sub 1) N-oxide, 1-hydroxy-2,3-dimethoxy-6-[(2Z,5Z,7Z,9S,10S,11Z)-10-methoxy-3,7,9,11-tetramethyltrideca-2,5,7,11-tetraenyl]-5-methylpyridin-4-one, 4-Pyridinol, 2,3-dimethoxy-6-(10-methoxy-3,7,9,11-tetramethyl-2,5,7,11-tridecatetraenyl)-5-methyl-, 1-oxide, (S-(R*,R*-(all-E)))-
| Molecular Formula | C26H39NO5 |
| Molecular Weight | 445.28284 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 68.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 445.28284 Da |
| Heavy Atoms | 32 |
| Complexity | 857.0 |
| SMILES | C/C=C(/C)\[C@H]([C@@H](C)/C=C(/C)\C=C/C/C(=C\CC1=C(C(=O)C(=C(N1O)OC)OC)C)/C)OC |
| InChIKey | UGGPSLQRTUOXFD-PUTCWZFGSA-N |
The XLogP value of 6.3 indicates that Piericidin B(sub 1) N-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Piericidin B(sub 1) N-oxide. Following Lipinski's Rule of Five, Piericidin B(sub 1) N-oxide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Piericidin B(sub 1) N-oxide is 139182-76-6.
The molecular formula of Piericidin B(sub 1) N-oxide is C26H39NO5.
The molecular weight of Piericidin B(sub 1) N-oxide is 445.28284 g/mol.
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