Systematic / IUPAC Name: 2,3-Dihydroxypropyl (5Z,11α,13E,15S)-11,15-dihydroxy-9-oxoprosta-5,13-dien-1-oate
ID: Reference4420
Other Names:
1(3)-Glyceryl-PGE2 ;
PGE2-G ;
9-Oxo-11α,15S-dihydroxy-prosta-5Z,13E-dien-1-oic acid, 2,3-dihydroxypropyl ester;
Prosta-5,13-dien-1-oic acid, 11,15-dihydroxy-9-oxo-, 2,3-dihydroxypropyl ester, (5Z,11α,13E,15S)-
Formula: C23H38O7
Class: Endogenous Metabolites
Prostaglandin E2-1-glyceryl ester 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 | 306 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 4/4/2016 12:14:27 PM |
InChI | InChI=1S/C23H38O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-20,22,24-26,28H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12+/t17-,18?,19+,20+,22+/m0/s1 |
InChI Key | RJXVYMMSQBYEHN-LVXZDWGESA-N |
Canonical SMILES | CCCCCC(C=CC1C(CC(=O)C1CC=CCCCC(=O)OCC(CO)O)O)O |
CAS | 37497475 |
Splash | |
Other Names |
1(3)-Glyceryl-PGE2 ; PGE2-G ; 9-Oxo-11α,15S-dihydroxy-prosta-5Z,13E-dien-1-oic acid, 2,3-dihydroxypropyl ester; Prosta-5,13-dien-1-oic acid, 11,15-dihydroxy-9-oxo-, 2,3-dihydroxypropyl ester, (5Z,11α,13E,15S)- |