Phosphatidylcholine alkyl 16:0-18:2
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT003051
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT003051 contains the MS3 mass spectrum of Phosphatidylcholine alkyl 16:0-18:2 with the InChIkey CBJWWPFFZRSLMX-WGPKDLKGSA-N.
Chemical Info
| InChI | InChI=1S/C42H82NO7P/c1-6-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-42(44)50-41(40-49-51(45,46)48-38-36-43(3,4)5)39-47-37-34-32-30-28-26-24-21-19-17-15-13-11-9-7-2/h23,25,29,31,41H,6-22,24,26-28,30,32-40H2,1-5H3/b25-23-,31-29- |
|---|---|
| SMILES | C(CC=CCCC(=O)OC(COCCCCCCCCCCCCCCCC)COP(OCC[N+1](C)(C)C)([O-1])=O)=CCCCCCCCCCC |
| InChI Key | CBJWWPFFZRSLMX-WGPKDLKGSA-N |
| Molecular Formula | C42H82NO7P |
| Exact Mass | 743.583 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 | 12629a7f-fe79-440b-84fb-449f4e109b6d |
| Package id | msbnk-chubu_univ-ut003051 |
| Resource type | HTML |
| State | active |