Dataset

Phosphatidylethanolamine 18:0-20:3

This MassBank record with Accession MSBNK-Chubu_Univ-UT001865 contains the MS2 mass spectrum of Phosphatidylethanolamine 18:0-20:3 with the InChIkey BDESLISUEJTDHD-JCXYTCFZSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C43H80NO8P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44)39-49-42(45)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h19-20,24,26,30,32,41H,3-18,21-23,25,27-29,31,33-40,44H2,1-2H3,(H,47,48)/b20-19-,26-24-,32-30-
SMILES C(CCCCCC)CCCCCCCCCCC(OCC(COP(O)(=O)OCCN)OC(=O)CCC=CCC=CCC=CCCCCCCCCC)=O
InChI Key BDESLISUEJTDHD-JCXYTCFZSA-N
Molecular Formula C43H80NO8P
Exact Mass 769.562 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-UT001865
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:47:39.859790
MetadataModified 2024-01-11T12:47:40.037465
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
134720506 PubChem
The data in this table is sourced from UniChem at EBI.