Phosphatidylcholine alkenyl 16:0-20:4
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT001330
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT001330 contains the MS2 mass spectrum of Phosphatidylcholine alkenyl 16:0-20:4 with the InChIkey WPFUZBNWEKXHJI-TUJGGYRWSA-N.
Chemical Info
| InChI | InChI=1S/C44H80NO7P/c1-6-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-44(46)52-43(42-51-53(47,48)50-40-38-45(3,4)5)41-49-39-36-34-32-30-28-26-21-19-17-15-13-11-9-7-2/h16,18,22-23,25,27,31,33,36,39,43H,6-15,17,19-21,24,26,28-30,32,34-35,37-38,40-42H2,1-5H3/b18-16-,23-22-,27-25-,33-31-,39-36+ |
|---|---|
| SMILES | C(CCCCCC)=CCC=CCC=CCC=CCCC(OC(COP(OCC[N+1](C)(C)C)([O-1])=O)COC=CCCCCCCCCCCCCCC)=O |
| InChI Key | WPFUZBNWEKXHJI-TUJGGYRWSA-N |
| Molecular Formula | C44H80NO7P |
| Exact Mass | 765.567 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 | 95a7ca93-df75-46b8-9901-6fae306216b8 |
| Package id | msbnk-chubu_univ-ut001330 |
| Resource type | HTML |
| State | active |