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Phosphatidylethanolamine 22:6-22:6

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT002633

Dataset description:

This MassBank record with Accession MSBNK-Chubu_Univ-UT002633 contains the MS2 mass spectrum of Phosphatidylethanolamine 22:6-22:6 with the InChIkey RBDNSJMXMWTPCS-GZSOIYOPSA-N.

Source: Phosphatidylethanolamine 22:6-22:6

Chemical Info

molecular Image

InChI	InChI=1S/C49H74NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-48(51)55-45-47(46-57-59(53,54)56-44-43-50)58-49(52)42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,23-26,29-32,35-38,47H,3-4,9-10,15-16,21-22,27-28,33-34,39-46,50H2,1-2H3,(H,53,54)/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-,32-30-,37-35-,38-36-
SMILES	O(C(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O)C(COP(OCCN)(O)=O)COC(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O
InChI Key	RBDNSJMXMWTPCS-GZSOIYOPSA-N
Molecular Formula	C49H74NO8P
Exact Mass	835.515 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	ea155e0a-6466-4837-9a82-a6f59e36338d
Package id	msbnk-chubu_univ-ut002633
Resource type	HTML
State	active