Dataset

Phosphatidylethanolamine alkenyl 20:1-18:2

This MassBank record with Accession MSBNK-Chubu_Univ-UT001909 contains the MS2 mass spectrum of Phosphatidylethanolamine alkenyl 20:1-18:2 with the InChIkey GPGJCRAIGHOCDQ-QGRKPBPISA-N.

Chemical Info

molecular Image
InChI InChI=1S/C43H82NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-38-48-40-42(41-50-52(46,47)49-39-37-44)51-43(45)36-34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h24,26,29-32,42H,3-23,25,27-28,33-41,44H2,1-2H3,(H,46,47)/b26-24-,31-29-,32-30-
SMILES C(CCCCC=CCC=CCCC(OC(COP(OCCN)(O)=O)COCCCC=CCCCCCCCCCCCCCCC)=O)CCCCC
InChI Key GPGJCRAIGHOCDQ-QGRKPBPISA-N
Molecular Formula C43H82NO7P
Exact Mass 755.583 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-UT001909
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:48:59.089201
MetadataModified 2024-01-11T12:48:59.241299
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
134733228 PubChem
The data in this table is sourced from UniChem at EBI.