Phosphatidylcholine 16:0-22:7
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT001758
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT001758 contains the MS2 mass spectrum of Phosphatidylcholine 16:0-22:7 with the InChIkey FXSXZNJPDJYSQF-YABKEOHFSA-N.
Source: Phosphatidylcholine 16:0-22:7
Chemical Info
| InChI | InChI=1S/C47H80NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-28-30-32-34-36-38-40-47(50)56-45(44-55-57(51,52)54-42-41-48(3,4)5)43-53-46(49)39-37-35-33-31-29-27-19-17-15-13-11-9-7-2/h6,10,12,16,18,21-22,24-25,28,30,34,36,45H,1,7-9,11,13-15,17,19-20,23,26-27,29,31-33,35,37-44H2,2-5H3/b12-10-,18-16-,22-21-,25-24-,30-28-,36-34- |
|---|---|
| SMILES | C(=CCC=CCC=CCC=CCCC(=O)OC(COP(OCC[N+1](C)(C)C)([O-1])=O)COC(=O)CCCCCCCCCCCCCCC)CC=CCC=CCC=C |
| InChI Key | FXSXZNJPDJYSQF-YABKEOHFSA-N |
| Molecular Formula | C47H80NO8P |
| Exact Mass | 817.562 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 | 9ec01a06-e5f0-412a-9944-1acc98d0e3b9 |
| Package id | msbnk-chubu_univ-ut001758 |
| Resource type | HTML |
| State | active |