Alantrypinone
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000413
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000413 contains the MS2 mass spectrum of Alantrypinone with the InChIkey COXWNIZQNAMTQL-NQERJWCQSA-N.
Source: Alantrypinone
Chemical Info
| InChI | InChI=1S/C21H16N4O3/c1-20-18-22-13-8-4-2-6-11(13)17(27)25(18)15(16(26)24-20)10-21(20)12-7-3-5-9-14(12)23-19(21)28/h2-9,15H,10H2,1H3,(H,23,28)(H,24,26)/t15-,20+,21+/m1/s1 |
|---|---|
| SMILES | C[C@]12C3=NC4=CC=CC=C4C(=O)N3[C@H](C[C@@]15C6=CC=CC=C6NC5=O)C(=O)N2 |
| InChI Key | COXWNIZQNAMTQL-NQERJWCQSA-N |
| Molecular Formula | C21H16N4O3 |
| Exact Mass | 372.122 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-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 60291f94-ee35-47c4-8e85-7db7a1de71e2 |
| Package id | msbnk-aafc-ac000413 |
| Resource type | HTML |
| State | active |