Phosphatidylcholine 20:0-20:4
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT001798
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT001798 contains the MS2 mass spectrum of Phosphatidylcholine 20:0-20:4 with the InChIkey LKDQVYYANCMMNT-CTMZMWSNSA-N.
Source: Phosphatidylcholine 20:0-20:4
Chemical Info
| InChI | InChI=1S/C48H88NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-47(50)54-44-46(45-56-58(52,53)55-43-42-49(3,4)5)57-48(51)41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h17,19,23,25,29,31,35,37,46H,6-16,18,20-22,24,26-28,30,32-34,36,38-45H2,1-5H3/b19-17-,25-23-,31-29-,37-35- |
|---|---|
| SMILES | C(=CCC=CCC=CCC=CCCC(=O)OC(COC(CCCCCCCCCCCCCCCCCCC)=O)COP(OCC[N+1](C)(C)C)([O-1])=O)CCCCCC |
| InChI Key | LKDQVYYANCMMNT-CTMZMWSNSA-N |
| Molecular Formula | C48H88NO8P |
| Exact Mass | 837.625 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 | fb33bfee-d418-4948-8750-f4695e94401d |
| Package id | msbnk-chubu_univ-ut001798 |
| Resource type | HTML |
| State | active |