Pimilprost

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Properties Simple | Detailed

Formula C23H40O5
IUPAC Name methyl 2-[2-[(2r,3as,4r,5r,6as)-5-hydroxy-4-[(e,3s,5s)-3-hydroxy-5-methyl-non-1-enyl]-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]ethoxy]acetate
Molecular Mass 396.561 g·mol−1
Heat of Formation -1132.6 ± 16.7 kJ·mol−1
Dipole Moment 4.98 ± 1.08 D
Volume 540.56 Å 3
Surface Area 396.55 Å 2
HOMO Energy -9.71 ± 0.55 eV
LUMO Energy 3.96 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[2-[(2r,3as,4r,5r,6as)-5-hydroxy-4-[(e,3s,5s)-3-hydroxy-5-methyl-non-1-enyl]-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]ethoxy]acetic acid methyl ester
  • 2-[2-[(2r,3as,4r,5r,6as)-5-hydroxy-4-[(e,3s,5s)-3-hydroxy-5-methylnon-1-enyl]-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]ethoxy]acetic acid methyl ester
  • d01188
  • methyl 2-[2-[(2r,3as,4r,5r,6as)-5-hydroxy-4-[(e,3s,5s)-3-hydroxy-5-methyl-non-1-enyl]-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]ethoxy]acetate
  • methyl 2-[2-[(2r,3as,4r,5r,6as)-5-hydroxy-4-[(e,3s,5s)-3-hydroxy-5-methyl-non-1-enyl]-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]ethoxy]ethanoate
  • methyl 2-[2-[(2r,3as,4r,5r,6as)-5-hydroxy-4-[(e,3s,5s)-3-hydroxy-5-methylnon-1-enyl]-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]ethoxy]acetate
  • pimilprost (jan)
  • skipron
  • sm-10902
InChIKey SLDLSMFNGFIPNI-RXYUHBJGSA-N
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