Dataset

Phosphatidylserine 17:0-20:4

This MassBank record with Accession MSBNK-Chubu_Univ-UT003079 contains the MS3 mass spectrum of Phosphatidylserine 17:0-20:4 with the InChIkey KHYYODUAXSQFEB-UWXMSWPTSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C44H78NO9P/c1-4-6-8-10-12-14-16-18-20-21-22-24-26-28-30-32-34-36-44(48)54-41(38-52-55(49,50)53-39-42(45)40(3)46)37-51-43(47)35-33-31-29-27-25-23-19-17-15-13-11-9-7-5-2/h14,16,20-21,24,26,30,32,41-42H,4-13,15,17-19,22-23,25,27-29,31,33-39,45H2,1-3H3,(H,49,50)/b16-14-,21-20-,26-24-,32-30-
SMILES C(CCCCCC)=CCC=CCC=CCC=CCCC(OC(COC(CCCCCCCCCCCCCCCC)=O)COP(O)(=O)OCC(N)C(C)=O)=O
InChI Key KHYYODUAXSQFEB-UWXMSWPTSA-N
Molecular Formula C44H78NO9P
Exact Mass 795.541 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-UT003079
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:46:39.497896
MetadataModified 2024-01-11T12:46:39.647980
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
134743816 PubChem
The data in this table is sourced from UniChem at EBI.