Phosphatidylcholine alkenyl 18:0-20:4
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT002539
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT002539 contains the MS2 mass spectrum of Phosphatidylcholine alkenyl 18:0-20:4 with the InChIkey HCYYHDMAKLYNDP-AYYWLCDQSA-N.
Chemical Info
| InChI | InChI=1S/C46H84NO7P/c1-6-8-10-12-14-16-18-20-22-24-25-27-29-31-33-35-37-39-46(48)54-45(44-53-55(49,50)52-42-40-47(3,4)5)43-51-41-38-36-34-32-30-28-26-23-21-19-17-15-13-11-9-7-2/h16,18,22,24,27,29,33,35,38,41,45H,6-15,17,19-21,23,25-26,28,30-32,34,36-37,39-40,42-44H2,1-5H3/b18-16-,24-22-,29-27-,35-33-,41-38+ |
|---|---|
| SMILES | C(C=CCC=CCC=CCC=CCCCCCC)CC(OC(COC=CCCCCCCCCCCCCCCCC)COP(OCC[N+1](C)(C)C)([O-1])=O)=O |
| InChI Key | HCYYHDMAKLYNDP-AYYWLCDQSA-N |
| Molecular Formula | C46H84NO7P |
| Exact Mass | 793.599 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 | 064e4600-4905-4887-88d8-942686464943 |
| Package id | msbnk-chubu_univ-ut002539 |
| Resource type | HTML |
| State | active |