TL;DR: Helmidiol (CAS 155326-45-7) is a chemical compound with molecular formula C16H24O6 and molecular weight 312.1573 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3Z,11Z)-5,13-dihydroxy-8,16-dimethyl-1,9-dioxacyclohexadeca-3,11-diene-2,10-dione
Also Known As: Helmidiol, Pyrenophorol [HelMidiol], Pyrenophorol [M+H]+, (3Z,11Z)-5,13-dihydroxy-8,16-dimethyl-1,9-dioxacyclohexadeca-3,11-diene-2,10-dione, 6,10,12-Octadecatrienoic acid,9-hydroxy-,methyl ester,(6Z,10E,12Z)
| Molecular Formula | C16H24O6 |
| Molecular Weight | 312.1573 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 312.1573 Da |
| Heavy Atoms | 22 |
| Complexity | 388.0 |
| SMILES | CC1OC(=O)/C=C\C(CCC(OC(=O)/C=C\C(CC1)O)C)O |
| InChIKey | RBQNDQOKFICJGL-XOHWUJONSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Helmidiol. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Helmidiol. Following Lipinski's Rule of Five, Helmidiol has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Helmidiol is 155326-45-7.
The molecular formula of Helmidiol is C16H24O6.
The molecular weight of Helmidiol is 312.1573 g/mol.
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