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Phosphatidylethanolamine 20:4-22:6

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT001156

Dataset description:

This MassBank record with Accession MSBNK-Chubu_Univ-UT001156 contains the MS2 mass spectrum of Phosphatidylethanolamine 20:4-22:6 with the InChIkey QYRBWBWQALDZGP-YARNEYDXSA-N.

Source: Phosphatidylethanolamine 20:4-22:6

Chemical Info

molecular Image

InChI	InChI=1S/C47H74NO8P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-40-47(50)56-45(44-55-57(51,52)54-42-41-48)43-53-46(49)39-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-17,19-20,22-24,27-30,33-36,45H,3-4,6,8-10,12,15,18,21,25-26,31-32,37-44,48H2,1-2H3,(H,51,52)/b7-5-,13-11-,16-14-,19-17-,23-20-,24-22-,29-27-,30-28-,35-33-,36-34-
SMILES	C(CC=CCC=CCCCCCC)=CCC=CCCC(OCC(OC(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O)COP(O)(=O)OCCN)=O
InChI Key	QYRBWBWQALDZGP-YARNEYDXSA-N
Molecular Formula	C47H74NO8P
Exact Mass	811.515 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	423d8e5f-429b-46c4-bd1d-c4806250d6a7
Package id	msbnk-chubu_univ-ut001156
Resource type	HTML
State	active