Dataset

Phosphatidylserine 16:0-20:4

This MassBank record with Accession MSBNK-Chubu_Univ-UT001247 contains the MS2 mass spectrum of Phosphatidylserine 16:0-20:4 with the InChIkey SPHVTAIQBHDJQC-WRDNLCFKSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C42H74NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-41(45)53-38(36-51-54(48,49)52-37-39(43)42(46)47)35-50-40(44)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h13,15,18-19,22,24,28,30,38-39H,3-12,14,16-17,20-21,23,25-27,29,31-37,43H2,1-2H3,(H,46,47)(H,48,49)/b15-13-,19-18-,24-22-,30-28-
SMILES C(N)(C(O)=O)COP(OCC(COC(CCCCCCCCCCCCCCC)=O)OC(=O)CCC=CCC=CCC=CCC=CCCCCCC)(O)=O
InChI Key SPHVTAIQBHDJQC-WRDNLCFKSA-N
Molecular Formula C42H74NO10P
Exact Mass 783.505 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-UT001247
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:47:10.570703
MetadataModified 2024-01-11T12:47:10.718572
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
134767492 PubChem
The data in this table is sourced from UniChem at EBI.