Phosphatidylcholine 16:1-22:6
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT001546
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT001546 contains the MS3 mass spectrum of Phosphatidylcholine 16:1-22:6 with the InChIkey ALJYHFIRPGURAF-DACYDXBYSA-N.
Source: Phosphatidylcholine 16:1-22:6
Chemical Info
| InChI | InChI=1S/C46H78NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-27-29-31-33-35-37-39-46(49)55-44(43-54-56(50,51)53-41-40-47(3,4)5)42-52-45(48)38-36-34-32-30-28-26-19-17-15-13-11-9-7-2/h8,10,14,16,20-21,23-24,27,29,32-35,44H,6-7,9,11-13,15,17-19,22,25-26,28,30-31,36-43H2,1-5H3/b10-8-,16-14-,21-20-,24-23-,29-27-,34-32-,35-33- |
|---|---|
| SMILES | C(CCCCC)CCCCCC=CCCC(=O)OCC(COP([O-1])(=O)OCC[N+1](C)(C)C)OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC |
| InChI Key | ALJYHFIRPGURAF-DACYDXBYSA-N |
| Molecular Formula | C46H78NO8P |
| Exact Mass | 803.547 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 | 92dccb66-b8e8-4069-a838-05db7c02bed3 |
| Package id | msbnk-chubu_univ-ut001546 |
| Resource type | HTML |
| State | active |