Phosphatidylethanolamine 17:0-22:6
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT002588
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT002588 contains the MS2 mass spectrum of Phosphatidylethanolamine 17:0-22:6 with the InChIkey WVGREBRFGJNLSB-KAFSZNKPSA-N.
Chemical Info
| InChI | InChI=1S/C44H76NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45)40-50-43(46)36-34-32-30-28-26-24-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,25,27,31,33,42H,3-4,6,8-10,12,14-16,18,20,23-24,26,28-30,32,34-41,45H2,1-2H3,(H,48,49)/b7-5-,13-11-,19-17-,22-21-,27-25-,33-31- |
|---|---|
| SMILES | C(CC)=CCC=CCC=CCC=CCC=CCC=CCCC(=O)OC(COP(OCCN)(O)=O)COC(CCCCCCCCCCCCCCCC)=O |
| InChI Key | WVGREBRFGJNLSB-KAFSZNKPSA-N |
| Molecular Formula | C44H76NO8P |
| Exact Mass | 777.531 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 | 809b8be9-dd85-4034-9b3d-f11d2a1fa255 |
| Package id | msbnk-chubu_univ-ut002588 |
| Resource type | HTML |
| State | active |