Dataset

Phosphatidylglyceride 18:0-18:2

This MassBank record with Accession MSBNK-Chubu_Univ-UT002681 contains the MS2 mass spectrum of Phosphatidylglyceride 18:0-18:2 with the InChIkey AOWDUWHTDPWHIC-JSCMVKKRSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C42H79O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(45)49-37-40(38-51-53(47,48)50-36-39(44)35-43)52-42(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h22,24,28,30,39-40,43-44H,3-21,23,25-27,29,31-38H2,1-2H3,(H,47,48)/b24-22-,30-28-
SMILES C(CCCCCC)CCCCCCCCCCC(=O)OCC(COP(OCC(O)CO)(O)=O)OC(=O)CCC=CCC=CCCCCCCCCCC
InChI Key AOWDUWHTDPWHIC-JSCMVKKRSA-N
Molecular Formula C42H79O10P
Exact Mass 774.541 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-UT002681
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:59:51.229711
MetadataModified 2025-02-09T08:58:30.596978
MetadataPublished 2016-01-19
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
134718942 PubChem
The data in this table is sourced from UniChem at EBI.