1-hexadecanoyl-2--(5Z,8Z,11Z,14Z-eicosatetraeno...
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_N107717_9EE2
Dataset description:
This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_N107717_9EE2 contains the MS2 mass spectrum of 1-hexadecanoyl-2--(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphocholine...
Source: 1-hexadecanoyl-2--(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphocholine
Chemical Info
| InChI | InChI=1S/C44H80NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2/h14,16,20-21,23,25,29,31,42H,6-13,15,17-19,22,24,26-28,30,32-41H2,1-5H3/b16-14-,21-20-,25-23-,31-29-/t42-/m1/s1 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
| InChI Key | IIZPXYDJLKNOIY-JXPKJXOSSA-N |
| Molecular Formula | C44H80NO8P |
| Exact Mass | 781.562 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 | No License Provided |
| Id | 358a4e46-ad61-4cbe-b877-11bce21ca47f |
| Package id | msbnk-antwerp_univ-metox_n107717_9ee2 |
| Resource type | HTML |
| State | active |