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Phosphatidylserine 20:4-22:6

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT001725

Dataset description:

This MassBank record with Accession MSBNK-Chubu_Univ-UT001725 contains the MS3 mass spectrum of Phosphatidylserine 20:4-22:6 with the InChIkey SHXDKXMAWBFERN-FEYKXOPTSA-N.

Source: Phosphatidylserine 20:4-22:6

Chemical Info

molecular Image

InChI	InChI=1S/C49H76NO9P/c1-4-6-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-37-39-41-49(53)59-46(43-57-60(54,55)58-44-47(50)45(3)51)42-56-48(52)40-38-36-34-32-30-28-26-24-21-19-17-15-13-11-9-7-5-2/h6,8,12,14-15,17-18,20-21,23-25,28-31,34-37,46-47H,4-5,7,9-11,13,16,19,22,26-27,32-33,38-44,50H2,1-3H3,(H,54,55)/b8-6-,14-12-,17-15-,20-18-,24-21-,25-23-,30-28-,31-29-,36-34-,37-35-
SMILES	C(=CCCC(=O)OC(COC(=O)CCC=CCC=CCC=CCC=CCCCCCC)COP(OCC(C(C)=O)N)(O)=O)CC=CCC=CCC=CCC=CCC=CCC
InChI Key	SHXDKXMAWBFERN-FEYKXOPTSA-N
Molecular Formula	C49H76NO9P
Exact Mass	853.526 g/mol

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Additional Information

Field	Value
Data last updated	January 11, 2024
Metadata last updated	January 11, 2024
Created	January 11, 2024
Format	HTML
License	Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0)
Id	020368b8-4b0d-4205-97a4-78d3ae449c97
Package id	msbnk-chubu_univ-ut001725
Resource type	HTML
State	active