Piperacillin sodium salt, Pentcillin, Pipril,...
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PT103220
Dataset description:
This MassBank record with Accession MSBNK-RIKEN_ReSpect-PT103220 contains the MS2 mass spectrum of Piperacillin sodium salt, Pentcillin, Pipril,...
Chemical Info
| InChI | InChI=1S/C23H27N5O7S/c1-4-26-10-11-27(19(32)18(26)31)22(35)25-13(12-8-6-5-7-9-12)16(29)24-14-17(30)28-15(21(33)34)23(2,3)36-20(14)28/h5-9,13-15,20H,4,10-11H2,1-3H3,(H,24,29)(H,25,35)(H,33,34) |
|---|---|
| SMILES | CCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CC=C2)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)O |
| InChI Key | IVBHGBMCVLDMKU-UHFFFAOYSA-N |
| Molecular Formula | C23H27N5O7S |
| Exact Mass | 517.562 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 | Attribution-NonCommercial 4.0 International (CC BY-NC 4.0) |
| Id | bd2d8efb-3ccc-496e-aa5f-aff6cffcbe29 |
| Package id | msbnk-riken_respect-pt103220 |
| Resource type | HTML |
| State | active |