Phosphatidylcholine 15:0-18:1 / 16:0-17:1
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT001649
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT001649 contains the MS3 mass spectrum of Phosphatidylcholine 15:0-18:1 / 16:0-17:1 with the InChIkey BZYSAXDHGHUZBC-NTICDTFDSA-N.
Chemical Info
| InChI | InChI=1S/2C41H80NO8P/c1-6-8-10-12-14-16-18-20-21-22-24-26-28-30-32-34-41(44)50-39(38-49-51(45,46)48-36-35-42(3,4)5)37-47-40(43)33-31-29-27-25-23-19-17-15-13-11-9-7-2;1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-41(44)50-39(38-49-51(45,46)48-36-35-42(3,4)5)37-47-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h2*28,30,39H,6-27,29,31-38H2,1-5H3/b2*30-28- |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CC/C=C\CCCCCCCCCCCC.CCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CC/C=C\CCCCCCCCCCCCC |
| InChI Key | BZYSAXDHGHUZBC-NTICDTFDSA-N |
| Molecular Formula | C82H160N2O16P2 |
| Exact Mass | 1491.124 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 | b8cc2dd5-49db-4c56-aef2-4d150b9f9e5d |
| Package id | msbnk-chubu_univ-ut001649 |
| Resource type | HTML |
| State | active |