N-Acetylprostaglandin E2 Carboxamide
[CAS# 52533-44-5]

Identification

• Name: N-Acetylprostaglandin E2 Carboxamide
• Synonyms: (Z)-N-Acetyl-7-[(1R,2R,3R)-3-Hydroxy-2-[(E,3S)-3-Hydroxyoct-1-Enyl]-5-Oxo-Cyclopentyl]Hept-5-Enamide; N-[(Z)-7-[(1R,2R,3R)-3-Hydroxy-2-[(E,3S)-3-Hydroxyoct-1-Enyl]-5-Keto-Cyclopentyl]Hept-5-Enoyl]Acetamide; (Z)-N-Ethanoyl-7-[(1R,2R,3R)-3-Hydroxy-2-[(E,3S)-3-Hydroxyoct-1-Enyl]-5-Oxo-Cyclopentyl]Hept-5-Enamide
• Molecular Formula: C₂₂H₃₅NO₅
• Molecular Weight: 393.52
• CAS Registry Number: 52533-44-5
• SMILES: [C@H]1([C@H](C(=O)C[C@H]1O)C\C=C/CCCC(=O)NC(=O)C)\C=C\[C@@H](O)CCCCC
• InChI: 1S/C22H35NO5/c1-3-4-7-10-17(25)13-14-19-18(20(26)15-21(19)27)11-8-5-6-9-12-22(28)23-16(2)24/h5,8,13-14,17-19,21,25,27H,3-4,6-7,9-12,15H2,1-2H3,(H,23,24,28)/b8-5-,14-13+/t17-,18+,19+,21+/m0/s1
• InChIKey: GGNHZXRCRZASKP-JTPNTKCXSA-N

Properties

• Density: 1.13g/cm³ (Cal.)
• Boiling point: 567.214°C at 760 mmHg (Cal.)
• Flash point: 296.84°C (Cal.)