CTK5A8686
methyl 7-[(1R,2S)-2-(4-hydroxy-4-methyloct-1-enyl)-5-oxocyclopent-3-en-1-yl]heptanoate
Also Known As: 16-Hydroxy-16-methyl-9-oxo-prosta-10,13-dien-1-oic acid methyl ester|Prosta-10,13-dien-1-oicacid, 16-hydroxy-16-methyl-9-oxo-, methyl ester, (13E)-(? currency)- (9CI)
CAS: 58682-86-3
| Molecular Formula | C22H36O4 |
|---|---|
| Molecular Weight | 364.26135 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 364.26135 |
| Monoisotopic Mass | 364.26135 |
| Heavy Atoms | 26 |
| Complexity | 494.0 |
Chemical Identifiers
| CAS Number | 58682-86-3 |
|---|---|
| SMILES | CCCCC(C)(CC=C[C@H]1C=CC(=O)[C@@H]1CCCCCCC(=O)OC)O |
| InChIKey | OCWJVIUDOHXKHI-ZKTCVHQMSA-N |
Product Overview
CTK5A8686 (CAS 58682-86-3), with molecular formula C22H36O4 and molecular weight 364.26135 g/mol. IUPAC: methyl 7-[(1R,2S)-2-(4-hydroxy-4-methyloct-1-enyl)-5-oxocyclopent-3-en-1-yl]heptanoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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