TL;DR: Dimethoxyipomine (CAS 110011-74-0) is a chemical compound with molecular formula C32H39NO10 and molecular weight 597.2574 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-3,5-dimethoxyphenyl)prop-2-enoate
Also Known As: Dimethoxyipomine, [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-3,5-dimethoxyphenyl)prop-2-enoate, beta-D-Glucopyranoside, 4-(1,2,3,5,8,8a-hexahydro-7-methyl-6-indolizinyl)phenyl, 6-(3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenoate), (1(S),6(E))-
| Molecular Formula | C32H39NO10 |
| Molecular Weight | 597.2574 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 147.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 10 |
| Exact Mass | 597.2574 Da |
| Heavy Atoms | 43 |
| Complexity | 983.0 |
| SMILES | CC1=C(CN2CCCC2C1)C3=CC=C(C=C3)OC4C(C(C(C(O4)COC(=O)/C=C/C5=CC(=C(C(=C5)OC)O)OC)O)O)O |
| InChIKey | ORINCJLXWYDTJY-IZZDOVSWSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethoxyipomine. The TPSA of 147.0 Ų indicates high polarity, suggesting Dimethoxyipomine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dimethoxyipomine has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Dimethoxyipomine is 110011-74-0.
The molecular formula of Dimethoxyipomine is C32H39NO10.
The molecular weight of Dimethoxyipomine is 597.2574 g/mol.
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