TL;DR: CTK5J3386 (CAS 121606-18-6) is a chemical compound with molecular formula C20H32O5 and molecular weight 352.22498 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
CTK5J3386
3-ethenyl-5,6,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-1-one
Also Known As: 7-Deacetyl-1-deoxyforskolin from Coleus forskohlii, 3-ethenyl-5,6,10b-trihydroxy-3,4a,7,7,10a-pentamethyldodecahydro-1h-benzo[f]chromen-1-one, 3-ethenyl-5,6,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-1-one
| Molecular Formula | C20H32O5 |
| Molecular Weight | 352.22498 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 87.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 352.22498 Da |
| Heavy Atoms | 25 |
| Complexity | 615.0 |
| SMILES | CC1(CCCC2(C1C(C(C3(C2(C(=O)CC(O3)(C)C=C)O)C)O)O)C)C |
| InChIKey | BEXJRVNGEWHUJR-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK5J3386. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK5J3386. Following Lipinski's Rule of Five, CTK5J3386 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of CTK5J3386 is 121606-18-6.
The molecular formula of CTK5J3386 is C20H32O5.
The molecular weight of CTK5J3386 is 352.22498 g/mol.
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