Tilsuprost
[CAS# 80225-28-1]

Identification

• Name: Tilsuprost
• Synonyms: 4-[[(3As,4S,5S,6Ar)-5-Hydroxy-4-[(E,3R)-3-Hydroxyoct-1-Enyl]-3,3A,4,5,6,6A-Hexahydrocyclopenta[D]Pyrrol-2-Yl]Thio]Butanoic Acid Methyl Ester; 4-[[(3As,4S,5S,6Ar)-5-Hydroxy-4-[(E,3R)-3-Hydroxyoct-1-Enyl]-3,3A,4,5,6,6A-Hexahydrocyclopenta[D]Pyrrol-2-Yl]Thio]Butyric Acid Methyl Ester; Methyl (+-)-4-(((3Ar*,4R*,5R*,6As*)-3,3A,4,5,6,6A-Hexahydro-5-Hydroxy-4-((E)-(3S*)-3-Hydroxy-1-Octenyl)Cyclopenta(B)Pyrrol-2-Yl)Thio)Butyrate
• Molecular Formula: C₂₀H₃₃NO₄S
• Molecular Weight: 383.55
• CAS Registry Number: 80225-28-1
• SMILES: [C@H]12[C@H](N=C(SCCCC(OC)=O)C1)C[C@H](O)[C@H]2\C=C\[C@H](O)CCCCC
• InChI: 1S/C20H33NO4S/c1-3-4-5-7-14(22)9-10-15-16-12-19(21-17(16)13-18(15)23)26-11-6-8-20(24)25-2/h9-10,14-18,22-23H,3-8,11-13H2,1-2H3/b10-9+/t14-,15+,16+,17-,18+/m1/s1
• InChIKey: TUOQTRVLPKMMDB-YSVNEXHHSA-N

Properties

• Density: 1.224g/cm³ (Cal.)
• Boiling point: 506.861°C at 760 mmHg (Cal.)
• Flash point: 260.34°C (Cal.)