Systematic / IUPAC Name: (5Z,8β,9β,11α,13E)-9,11-Dihydroxy-15-oxoprosta-5,13-dien-1-oic acid
ID: Reference4598
Other Names:
Prosta-5,13-dien-1-oic acid, 9,11-dihydroxy-15-oxo-, (5Z,8β,9β,11α,13E)-;
8-Iso-15-keto-PGF2β
Formula: C20H32O5
Class: Endogenous Metabolites
8-Iso-15-keto-prostaglandin-F2β mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Elite; Orbitrap Fusion with FAIMS |
No. of Spectral Trees | 3 |
No. of Spectra | 9386 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | IT; FT |
Last Modification | 4/20/2016 11:25:55 AM |
InChI | InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,16-19,22-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t16-,17+,18+,19+/m0/s1 |
InChI Key | LOLJEILMPWPILA-WZDCOHRSSA-N |
Canonical SMILES | CCCCCC(=O)C=CC1C(CC(C1CC=CCCCC(=O)O)O)O |
CAS | 1621482367 |
Splash | |
Other Names |
Prosta-5,13-dien-1-oic acid, 9,11-dihydroxy-15-oxo-, (5Z,8β,9β,11α,13E)-; 8-Iso-15-keto-PGF2β |