Systematic / IUPAC Name: (5Z,9β,11α,13E,15S)-9,11,15-Trihydroxyprosta-5,13-dien-1-oic acid
ID: Reference9809
Other Names:
9b,11a-PGF2;
9β,11α-PGF2a;
9β,11α-PGF2α;
9β,11α-Prostaglandin F2;
PGF2b
; more
Formula: C20H34O5
Class: Endogenous Metabolites
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 Fusion with FAIMS |
No. of Spectral Trees | 1 |
No. of Spectra | 2587 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 7/2/2020 12:37:31 PM |
InChI | InChI=1S/C20H34O5/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/h4,7,12-13,15-19,21-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,18+,19+/m0/s1 |
InChI Key | PXGPLTODNUVGFL-JZFBHDEDSA-N |
Canonical SMILES | CCCCCC(C=CC1C(CC(C1CC=CCCCC(=O)O)O)O)O |
CAS | 4510161 |
Splash | |
Other Names |
9b,11a-PGF2; 9β,11α-PGF2a; 9β,11α-PGF2α; 9β,11α-Prostaglandin F2; PGF2b; PGF2β; Prostaglandin F2b; (5Z,13E)-9,11,15-Trihydroxy-prosta-5,13-dien-1-oate; (5Z,13E)-9,11,15-Trihydroxy-prosta-5,13-dien-1-oic acid; (5Z,13E,15S)-9β,11α,15-Trihydroxyprosta-5,13-dien-1-oic acid; 5-Heptenoic acid, 7-[3,5-dihydroxy-2(3-hydroxy-1-octenyl)cyclopentyl]-, stereoisomer; 7-[3,5-Dihydroxy-2-(3-hydroxy-1-octenyl)cyclopentyl]-5-heptenoate; 7-[3,5-Dihydroxy-2-(3-hydroxy-1-octenyl)cyclopentyl]-5-heptenoic acid stereoisomer; 7-[3a,5b-Dihydroxy-2-(3-hydroxy-1-octenyl)cyclopentyl]-5-heptenoate; 7-[3a,5b-Dihydroxy-2-(3-hydroxy-1-octenyl)cyclopentyl]-5-heptenoic acid; 9R,11R,15S-Trihydroxy-5Z,13E-prostadienoic acid; Prosta-5,13-dien-1-oic acid, 9,11,15-trihydroxy-,(5Z,9β,11α,13E,15S)-; 9β-PGF2α |
ChemSpider | 4444144 |
ChEBI | CHEBI:28922 |
ChEMBL | CHEMBL1894513 |
HMDb | HMDB0001483 |
PubChem | 5280506 |
KEGG | C02314 |