Dataset

Phosphatidylethanolamine 16:0-16:0

This MassBank record with Accession MSBNK-Chubu_Univ-UT001356 contains the MS2 mass spectrum of Phosphatidylethanolamine 16:0-16:0 with the InChIkey SLKDGVPOSSLUAI-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C37H74NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-36(39)43-33-35(34-45-47(41,42)44-32-31-38)46-37(40)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35H,3-34,38H2,1-2H3,(H,41,42)
SMILES C(CCCC(=O)OCC(COP(OCCN)(O)=O)OC(CCCCCCCCCCCCCCC)=O)CCCCCCCCCCC
InChI Key SLKDGVPOSSLUAI-UHFFFAOYSA-N
Molecular Formula C37H74NO8P
Exact Mass 691.515 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-UT001356
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T13:02:31.994327
MetadataModified 2025-02-09T08:58:26.608865
MetadataPublished 2016-01-19
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
65109 PubChem
HYA85H5S0G FDA SRS
HMDB0246972 Human Metabolome Database
J108.538G Nikkaji
47623 Brenda
20247 Brenda
244505 Brenda
14679682 PubChem
PD043169 ProbesDrugs
507096 eMolecules
5681-36-7 ACToR
14888505 PubChem: Thomson Pharma
3026-45-7 ACToR
SCHEMBL2733807 SureChEMBL
The data in this table is sourced from UniChem at EBI.