13,14-Dehydroprostaglandin I2 Methyl Ester
[CAS# 64079-44-3]

Identification

• Name: 13,14-Dehydroprostaglandin I2 Methyl Ester
• Synonyms: (5Z)-5-[(3Ar,4S,5R,6Ar)-5-Hydroxy-4-[(3S)-3-Hydroxyoct-1-Ynyl]-3,3A,4,5,6,6A-Hexahydrocyclopenta[D]Furan-2-Ylidene]Pentanoic Acid Methyl Ester; (5Z)-5-[(3Ar,4S,5R,6Ar)-5-Hydroxy-4-[(3S)-3-Hydroxyoct-1-Ynyl]-3,3A,4,5,6,6A-Hexahydrocyclopenta[D]Furan-2-Ylidene]Valeric Acid Methyl Ester; 13,14-Dehydro Pgi2 Methyl Ester
• Molecular Formula: C₂₁H₃₂O₅
• Molecular Weight: 364.48
• CAS Registry Number: 64079-44-3
• SMILES: [C@H]12OC(/C[C@@H]1[C@H]([C@H](O)C2)C#C[C@@H](O)CCCCC)=C\CCCC(OC)=O
• InChI: 1S/C21H32O5/c1-3-4-5-8-15(22)11-12-17-18-13-16(26-20(18)14-19(17)23)9-6-7-10-21(24)25-2/h9,15,17-20,22-23H,3-8,10,13-14H2,1-2H3/b16-9-/t15-,17+,18+,19+,20+/m0/s1
• InChIKey: KPWHKFPEWPYFQN-QCTGZTBPSA-N