Phosphatidylserine 18:0-20:1 / 18:1-20:0
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT003168
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT003168 contains the MS3 mass spectrum of Phosphatidylserine 18:0-20:1 / 18:1-20:0 with the InChIkey WMLWTLZCOCSYKV-LDZJKDEISA-N.
Chemical Info
| InChI | InChI=1S/2C44H84NO10P/c2*1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h30,32,40-41H,3-29,31,33-39,45H2,1-2H3,(H,48,49)(H,50,51);29,31,40-41H,3-28,30,32-39,45H2,1-2H3,(H,48,49)(H,50,51)/b32-30-;31-29- |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CC/C=C\CCCCCCCCCCCCC)COP(=O)(O)OCC(C(=O)O)N.CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC(C(=O)O)N)OC(=O)CC/C=C\CCCCCCCCCCCCCCC |
| InChI Key | WMLWTLZCOCSYKV-LDZJKDEISA-N |
| Molecular Formula | C88H168N2O20P2 |
| Exact Mass | 1635.167 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 | 63fab3c0-f141-429a-bd96-f01afaaa30f2 |
| Package id | msbnk-chubu_univ-ut003168 |
| Resource type | HTML |
| State | active |