LTB4_20-Hydroxy
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT000295
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT000295 contains the MS2 mass spectrum of LTB4_20-Hydroxy with the InChIkey PTJFJXLGRSTECQ-PSPARDEHSA-N.
Source: LTB4_20-Hydroxy
Chemical Info
| InChI | InChI=1S/C20H32O5/c21-17-10-6-2-1-3-7-12-18(22)13-8-4-5-9-14-19(23)15-11-16-20(24)25/h3-5,7-9,13-14,18-19,21-23H,1-2,6,10-12,15-17H2,(H,24,25)/b5-4+,7-3-,13-8+,14-9-/t18-,19-/m1/s1 |
|---|---|
| SMILES | OCCCCCC=CCC(O)C=CC=CC=CC(O)CCCC(O)=O |
| InChI Key | PTJFJXLGRSTECQ-PSPARDEHSA-N |
| Molecular Formula | C20H32O5 |
| Exact Mass | 352.225 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 | 583213d2-510e-4e1e-8d24-9f907ff38831 |
| Package id | msbnk-chubu_univ-ut000295 |
| Resource type | HTML |
| State | active |