Phosphatidylcholine 18:1-20:4
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT002788
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT002788 contains the MS2 mass spectrum of Phosphatidylcholine 18:1-20:4 with the InChIkey HYDKDXOLAXLJKA-ICTLDNOWSA-N.
Source: Phosphatidylcholine 18:1-20:4
Chemical Info
| InChI | InChI=1S/C46H82NO8P/c1-6-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-37-39-46(49)55-44(43-54-56(50,51)53-41-40-47(3,4)5)42-52-45(48)38-36-34-32-30-28-26-24-21-19-17-15-13-11-9-7-2/h16,18,22-23,27,29,32-35,44H,6-15,17,19-21,24-26,28,30-31,36-43H2,1-5H3/b18-16-,23-22-,29-27-,34-32-,35-33- |
|---|---|
| SMILES | C(CCCC=CCC=CCC=CCC=CCCC(=O)OC(COP([O-1])(=O)OCC[N+1](C)(C)C)COC(CCC=CCCCCCCCCCCCCC)=O)CC |
| InChI Key | HYDKDXOLAXLJKA-ICTLDNOWSA-N |
| Molecular Formula | C46H82NO8P |
| Exact Mass | 807.578 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 | 775a2b86-8386-44b2-8b0e-5ab93f8c7980 |
| Package id | msbnk-chubu_univ-ut002788 |
| Resource type | HTML |
| State | active |