Systematic / IUPAC Name: (9α,13E,15S)-9,15-Dihydroxyprost-13-en-1-oic acid
ID: Reference4731
Other Names:
11-Deoxy-PGF1α ;
7-{(1R,2S,5R)-2-Hydroxy-5-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl}heptanoic acid ;
9S,15S-Dihydroxy-13E-prostaenoic acid;
Prost-13-en-1-oic acid, 9,15-dihydroxy-, (9α,13E,15S)-
Formula: C20H36O4
Class: Endogenous Metabolites
11-Deoxy prostaglandin F1α mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Elite |
No. of Spectral Trees | 1 |
No. of Spectra | 143 |
Tandem Spectra | MS1, MS2, MS3 |
Ionization Methods | NSI |
Analyzers | IT; FT |
Last Modification | 5/9/2016 8:34:11 AM |
InChI | InChI=1S/C20H36O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h12,14,16-19,21-22H,2-11,13,15H2,1H3,(H,23,24)/b14-12+/t16-,17-,18+,19-/m0/s1 |
InChI Key | HYBPXYQCXNOTFK-DUSCRHDRSA-N |
Canonical SMILES | CCCCCC(C=CC1CCC(C1CCCCCCC(=O)O)O)O |
CAS | 37785981 |
Splash | |
Other Names |
11-Deoxy-PGF1α ; 7-{(1R,2S,5R)-2-Hydroxy-5-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl}heptanoic acid ; 9S,15S-Dihydroxy-13E-prostaenoic acid; Prost-13-en-1-oic acid, 9,15-dihydroxy-, (9α,13E,15S)- |
ChemIDPlus | 037785981 |
ChemSpider | 4446196 |
PubChem | 5283069 |
LipidsMAPs | LMFA03010068 |