TL;DR: Methoxyipomine (CAS 110011-73-9) is a chemical compound with molecular formula C31H37NO9 and molecular weight 567.2468 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3,4,5-trihydroxy-6-[4-(7-methyl-1,2,3,5,8,8a-hexahydroindolizin-6-yl)phenoxy]oxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Also Known As: Methoxyipomine, [3,4,5-trihydroxy-6-[4-(7-methyl-1,2,3,5,8,8a-hexahydroindolizin-6-yl)phenoxy]oxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
| Molecular Formula | C31H37NO9 |
| Molecular Weight | 567.2468 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 138.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 567.2468 Da |
| Heavy Atoms | 41 |
| Complexity | 948.0 |
| SMILES | CC1=C(CN2CCCC2C1)C3=CC=C(C=C3)OC4C(C(C(C(O4)COC(=O)/C=C/C5=CC(=C(C=C5)O)OC)O)O)O |
| InChIKey | CBZLQXLOZOWNCD-WUXMJOGZSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methoxyipomine. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methoxyipomine. Following Lipinski's Rule of Five, Methoxyipomine has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Methoxyipomine is 110011-73-9.
The molecular formula of Methoxyipomine is C31H37NO9.
The molecular weight of Methoxyipomine is 567.2468 g/mol.
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