Systematic / IUPAC Name: (6E,9α,11α,12α,14Z)-5,9,11-Trihydroxyprosta-6,14-dien-1-oic acid
ID: Reference9764
Other Names:
(12α)-5,9α,11α-Trihydroxy-prosta-6E,14Z-dien-1-oic acid;
Prosta-6,14-dien-1-oic acid, 5,9,11-trihydroxy-, (6E,9α,11α,12α,14Z)-;
8,12-iso-Isoprostane-F2α-VI;
12-iso-5,6E,14Z-PGF2α;
12-iso-5,6E,14Z-Prostaglandin F2α
Formula: C20H34O5
Class: Endogenous Metabolites
8,12-iso-iPF2α-VI mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion with FAIMS |
No. of Spectral Trees | 1 |
No. of Spectra | 1603 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 6/12/2020 6:39:28 AM |
InChI | InChI=1S/C20H34O5/c1-2-3-4-5-6-7-10-16-17(19(23)14-18(16)22)13-12-15(21)9-8-11-20(24)25/h6-7,12-13,15-19,21-23H,2-5,8-11,14H2,1H3,(H,24,25)/b7-6-,13-12+/t15?,16-,17+,18+,19-/m0/s1 |
InChI Key | RZCPXIZGLPAGEV-DCOIXEBESA-N |
Canonical SMILES | CCCCC/C=C\C[C@@H]1[C@@H](C[C@@H]([C@@H]1/C=C/C(CCCC(=O)O)O)O)O |
CAS | 1445349994 |
Splash | |
Other Names |
(12α)-5,9α,11α-Trihydroxy-prosta-6E,14Z-dien-1-oic acid; Prosta-6,14-dien-1-oic acid, 5,9,11-trihydroxy-, (6E,9α,11α,12α,14Z)-; 8,12-iso-Isoprostane-F2α-VI; 12-iso-5,6E,14Z-PGF2α; 12-iso-5,6E,14Z-Prostaglandin F2α |
ChemSpider | 45743365 |