TL;DR: Tricyclo[12.3.1.12,6]nonadeca-1(18),2,4,6(19),14,16-hexaene-3,9,17-triol (CAS 150107-14-5) is a chemical compound with molecular formula C19H22O3 and molecular weight 298.1569 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tricyclo[12.3.1.12,6]nonadeca-1(17),2,4,6(19),14(18),15-hexaene-3,9,17-triol
Also Known As: acerogenin K, Tricyclo[12.3.1.12,6]nonadeca-1(18),2,4,6(19),14,16-hexaene-3,9,17-triol, 1,2(1,3)-Dibenzenacyclononaphane-1~6~,2~6~,5-triol, 5,5 -(3-Hydroxy-1,7-heptanediyl)biphenyl-2,2 -diol, 5,5 -(3-Hydroxyheptane-1,7-diyl)biphenyl-2,2 -diol
| Molecular Formula | C19H22O3 |
| Molecular Weight | 298.1569 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 298.1569 Da |
| Heavy Atoms | 22 |
| Complexity | 346.0 |
| SMILES | C1CCC2=CC(=C(C=C2)O)C3=C(C=CC(=C3)CCC(C1)O)O |
| InChIKey | OUMFOFAOVINTGW-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that Tricyclo[12.3.1.12,6]nonadeca-1(18),2,4,6(19),14,16-hexaene-3,9,17-triol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Tricyclo[12.3.1.12,6]nonadeca-1(18),2,4,6(19),14,16-hexaene-3,9,17-triol. Following Lipinski's Rule of Five, Tricyclo[12.3.1.12,6]nonadeca-1(18),2,4,6(19),14,16-hexaene-3,9,17-triol has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Tricyclo[12.3.1.12,6]nonadeca-1(18),2,4,6(19),14,16-hexaene-3,9,17-triol is 150107-14-5.
The molecular formula of Tricyclo[12.3.1.12,6]nonadeca-1(18),2,4,6(19),14,16-hexaene-3,9,17-triol is C19H22O3.
The molecular weight of Tricyclo[12.3.1.12,6]nonadeca-1(18),2,4,6(19),14,16-hexaene-3,9,17-triol is 298.1569 g/mol.
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