Dataset

Phosphatidylethanolamine 16:0-22:5

This MassBank record with Accession MSBNK-Chubu_Univ-UT002833 contains the MS2 mass spectrum of Phosphatidylethanolamine 16:0-22:5 with the InChIkey VFGMWCSZLGEBAJ-XONGEEKRSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C43H76NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44)39-49-42(45)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h11,13,17-18,20-21,24,26,30,32,41H,3-10,12,14-16,19,22-23,25,27-29,31,33-40,44H2,1-2H3,(H,47,48)/b13-11-,18-17-,21-20-,26-24-,32-30-
SMILES OP(=O)(OCCN)OCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCC=CCC=CCC=CCC=CCC=CCCCCC
InChI Key VFGMWCSZLGEBAJ-XONGEEKRSA-N
Molecular Formula C43H76NO8P
Exact Mass 765.531 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT002833
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:47:09.036105
MetadataModified 2024-01-11T12:47:09.186047
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
134772839 PubChem
The data in this table is sourced from UniChem at EBI.