Phosphatidylcholine 17:1-18:1
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT001305
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT001305 contains the MS2 mass spectrum of Phosphatidylcholine 17:1-18:1 with the InChIkey OPXAZFYJOBVDTP-SZDCHMHBSA-N.
Source: Phosphatidylcholine 17:1-18:1
Chemical Info
| InChI | InChI=1S/C43H82NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44(3,4)5)39-49-42(45)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h29-32,41H,6-28,33-40H2,1-5H3/b31-29-,32-30- |
|---|---|
| SMILES | O(CC(OC(=O)CCC=CCCCCCCCCCCCCC)COP(OCC[N+1](C)(C)C)([O-1])=O)C(=O)CCC=CCCCCCCCCCCCC |
| InChI Key | OPXAZFYJOBVDTP-SZDCHMHBSA-N |
| Molecular Formula | C43H82NO8P |
| Exact Mass | 771.578 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 | 94db6684-b7ac-497c-808e-4750d4528775 |
| Package id | msbnk-chubu_univ-ut001305 |
| Resource type | HTML |
| State | active |