Phosphatidylcholine 19:0-18:2
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT001794
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT001794 contains the MS2 mass spectrum of Phosphatidylcholine 19:0-18:2 with the InChIkey BESSFRQTRGTUBA-XJKRCVSZSA-N.
Source: Phosphatidylcholine 19:0-18:2
Chemical Info
| InChI | InChI=1S/C45H86NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-29-31-33-35-37-44(47)51-41-43(42-53-55(49,50)52-40-39-46(3,4)5)54-45(48)38-36-34-32-30-28-26-23-21-19-17-15-13-11-9-7-2/h26,28,32,34,43H,6-25,27,29-31,33,35-42H2,1-5H3/b28-26-,34-32- |
|---|---|
| SMILES | C(CCCCCCCCCCCC(=O)OCC(COP(OCC[N+1](C)(C)C)([O-1])=O)OC(=O)CCC=CCC=CCCCCCCCCCC)CCCCCC |
| InChI Key | BESSFRQTRGTUBA-XJKRCVSZSA-N |
| Molecular Formula | C45H86NO8P |
| Exact Mass | 799.609 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 | ec14c691-8124-4e4a-9385-1150ca7e5b19 |
| Package id | msbnk-chubu_univ-ut001794 |
| Resource type | HTML |
| State | active |