Cas no 23923-84-4 (Tetranor-PGE1)

Tetranor-PGE1 structure
Tetranor-PGE1 structure
Product Name:Tetranor-PGE1
CAS No:23923-84-4
MF:C16H26O5
MW:298.374645709991
CID:272107
PubChem ID:6449794
Update Time:2025-04-19

Tetranor-PGE1 Chemical and Physical Properties

Names and Identifiers

    • Cyclopentanepropanoicacid, 3-hydroxy-2-[(1E,3S)-3-hydroxy-1-octen-1-yl]-5-oxo-, (1R,2R,3R)-
    • Tetranor-PGE1
    • Tetranor-PGE2
    • 3-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]propanoic acid
    • Tetranorprostaglandin E1
    • LMFA03010211
    • Q58339540
    • Cyclopentanepropanoic acid, 3-hydroxy-2-(3-hydroxy-1-octenyl)-5-oxo-, (1R-(1alpha,2beta(1E,3S*),3alpha))-
    • 2,3,4,5-tetranor-9-oxo-11R,15S-dihydroxy-13E-prostenoic acid
    • 23923-84-4
    • CHEBI:165344
    • tetranor-Prostaglandin E1
    • Inchi: 1S/C16H26O5/c1-2-3-4-5-11(17)6-7-12-13(8-9-16(20)21)15(19)10-14(12)18/h6-7,11-14,17-18H,2-5,8-10H2,1H3,(H,20,21)/b7-6+/t11-,12+,13+,14+/m0/s1
    • InChI Key: FPTFFTMXBKQFKC-JZKKULJYSA-N
    • SMILES: O[C@@H]1CC([C@H](CCC(=O)O)[C@H]1/C=C/[C@H](CCCCC)O)=O

Computed Properties

  • Exact Mass: 298.17808
  • Monoisotopic Mass: 298.178024
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 9
  • Complexity: 377
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.2
  • Topological Polar Surface Area: 94.8
  • Molecular Weight: 298.37

Experimental Properties

  • Density: 1.206
  • Boiling Point: 488.3°C at 760 mmHg
  • Flash Point: 263.2°C
  • Refractive Index: 1.566
  • PSA: 94.83
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