TL;DR: 7,8-Epoxy-2,11-cembradiene-4,6-diol (CAS 107856-82-6) is a chemical compound with molecular formula C20H34O3 and molecular weight 322.2508 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,2R,4S,5Z,7S,10Z)-4,10,14-trimethyl-7-propan-2-yl-15-oxabicyclo[12.1.0]pentadeca-5,10-diene-2,4-diol
Also Known As: 7,8-Ecd, L-Asparagine, N2-L-prolyl-, 7,8-Epoxy-2,11-cembradiene-4,6-diol, (1R,2R,4S,5Z,7S,10Z)-4,10,14-trimethyl-7-propan-2-yl-15-oxabicyclo[12.1.0]pentadeca-5,10-diene-2,4-diol, 15-Oxabicyclo(12.1.0)pentadeca-5,10-diene-2,4-diol, 4,10,14-trimethyl-7-(1-methylethyl)-, (1R-(1R*,2R*,4S*,5E,7S*,10R*))-
| Molecular Formula | C20H34O3 |
| Molecular Weight | 322.2508 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 53.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 322.2508 Da |
| Heavy Atoms | 23 |
| Complexity | 468.0 |
| SMILES | C/C/1=C/CCC2([C@H](O2)[C@@H](C[C@](/C=C\[C@@H](CC1)C(C)C)(C)O)O)C |
| InChIKey | RLYASSMUZMAUCA-FWNBTYLKSA-N |
The XLogP value of 3.5 indicates that 7,8-Epoxy-2,11-cembradiene-4,6-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.0 Ų, 7,8-Epoxy-2,11-cembradiene-4,6-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7,8-Epoxy-2,11-cembradiene-4,6-diol has 2 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 7,8-Epoxy-2,11-cembradiene-4,6-diol is 107856-82-6.
The molecular formula of 7,8-Epoxy-2,11-cembradiene-4,6-diol is C20H34O3.
The molecular weight of 7,8-Epoxy-2,11-cembradiene-4,6-diol is 322.2508 g/mol.
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