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7-[3,5-dihydroxy-2-(5-hydroxy-1,3-decadienyl)cyclopentyl]-5-heptenoicacid, methyl ester, [1.alpha.(Z),2.beta.(1E,3E,5S),3.alpha.,5.alpha.]-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

7-[3,5-dihydroxy-2-(5-hydroxy-1,3-decadienyl)cyclopentyl]-5-heptenoicacid, methyl ester, [1.alpha.(Z),2.beta.(1E,3E,5S),3.alpha.,5.alpha.]-
SpectraBase Compound ID JkBiqhT6mIO
InChI InChI=1S/C23H38O5/c1-3-4-7-12-18(24)13-10-11-15-20-19(21(25)17-22(20)26)14-8-5-6-9-16-23(27)28-2/h5,8,10-11,13,15,18-22,24-26H,3-4,6-7,9,12,14,16-17H2,1-2H3/b8-5-,13-10+,15-11+/t18?,19-,20-,21+,22-/m1/s1
InChIKey HYOBYNRTYPKKIE-PFTKIELSSA-N
Mol Weight 394.6 g/mol
Molecular Formula C23H38O5
Exact Mass 394.271924 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3dFOvtE0EUP
Name 7-[3,5-Dihydroxy-2-(5-hydroxy-1,3-decadienyl)cyclopentyl]-5-heptenoicacid, methyl ester, [1alpha(Z),2beta(1E,3E,5S),3alpha,5alpha]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 394.271924319 u
Formula C23H38O5
InChI InChI=1S/C23H38O5/c1-3-4-7-12-18(24)13-10-11-15-20-19(21(25)17-22(20)26)14-8-5-6-9-16-23(27)28-2/h5,8,10-11,13,15,18-22,24-26H,3-4,6-7,9,12,14,16-17H2,1-2H3/b8-5-,13-10+,15-11+/t18?,19-,20-,21+,22-/m1/s1
InChIKey HYOBYNRTYPKKIE-PFTKIELSSA-N
Molecular Weight 394.552 g/mol
SMILES [C@@]1([C@]([C@@](O)(C[C@]1(O)[H])[H])(C\C=C/CCCC(=O)OC)[H])(\C=C\C=C\C(O)CCCCC)[H]