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4-[2-[(3aS,5R,6R,6aS)-5-hydroxy-6-[(E,3S,5S)-3-hydroxy-5-methyl-non-1-enyl]-1,3a,4,5,6,6a-hexahydropentalen-2-yl]ethyl]benzoic acid

Compound with spectra: 1 MS (GC)

4-[2-[(3aS,5R,6R,6aS)-5-hydroxy-6-[(E,3S,5S)-3-hydroxy-5-methyl-non-1-enyl]-1,3a,4,5,6,6a-hexahydropentalen-2-yl]ethyl]benzoic acid
SpectraBase Compound ID DQsX3bkjBVe
InChI InChI=1S/C27H38O4/c1-3-4-5-18(2)14-23(28)12-13-24-25-16-20(15-22(25)17-26(24)29)7-6-19-8-10-21(11-9-19)27(30)31/h8-13,15,18,22-26,28-29H,3-7,14,16-17H2,1-2H3,(H,30,31)/b13-12+/t18-,22?,23+,24+,25?,26+/m0/s1
InChIKey VECVFTDQQWABTG-XGDYSPOJSA-N
Mol Weight 426.6 g/mol
Molecular Formula C27H38O4
Exact Mass 426.27701 g/mol
Enantiomer InChIKey VECVFTDQQWABTG-YQZFBUTASA-N

View Spectrum of 4-[2-[(3aS,5R,6R,6aS)-5-hydroxy-6-[(E,3S,5S)-3-hydroxy-5-methyl-non-1-enyl]-1,3a,4,5,6,6a-hexahydropentalen-2-yl]ethyl]benzoic acid

MS (GC) Spectrum
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Source of Spectrum F-51-5540-15
(1S,5S,6R,7R)-3-[2-(4-Carboxyphenyl)ethyl]-7-hydroxy-6-[(ES)-3-hydroxy-1-octenyl]bicyclo[3.3.0]-2-octene
(1S,5S,6R,7R)-7-Hydroxy-6-[(E,S)-3-hydroxy-1-octenyl]-3-[2-(4-methoxycarbonylphenyl)ethyl]bicyclo[3.3.0]-2-octene
(1S,5S,6R,7R)-3-[2-(4-Carboxyphenyl)ethyl]-7-hydroxy-6-[(E,S)-4-hydroxy-4-methyl-1-octenyl]-bicyclo[3.3.0]-2-octene
PGI-2
Prostacyclin
6-EXO-4E-PROSTAGLANDIN PGI2 METHYL ESTER
6-ENDO-4E-PROSTAGLANDIN PGI2 METHYL ESTER
6-(3'-ALPHA-HYDROXY-4'-META-CHLOROPHENOXYBUT-1'E-ENYL)-7-HYDROXY-3-OXABICYCLO[3.3.0]OCTAN-2-ONE
9-exo-Ethoxy-exo-tricyclo(5.2.1.0/2,6/)dec-3-en-5-endo-ol
5-ETHOXY-1-HYDROXY-EXO-5,6-DIHYDRODICYCLOPENTADIENE
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