Ajmalicine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fiocruz-FIO00001
Dataset description:
This MassBank record with Accession MSBNK-Fiocruz-FIO00001 contains the MS2 mass spectrum of Ajmalicine with the InChIkey GRTOGORTSDXSFK-XJTZBENFSA-N.
Source: Ajmalicine
Chemical Info
| InChI | InChI=1S/C21H24N2O3/c1-12-16-10-23-8-7-14-13-5-3-4-6-18(13)22-20(14)19(23)9-15(16)17(11-26-12)21(24)25-2/h3-6,11-12,15-16,19,22H,7-10H2,1-2H3/t12-,15-,16+,19-/m0/s1 |
|---|---|
| SMILES | CC1C2CN3CCC4=C(C3CC2C(=CO1)C(=O)OC)NC5=CC=CC=C45 |
| InChI Key | GRTOGORTSDXSFK-XJTZBENFSA-N |
| Molecular Formula | C21H24N2O3 |
| Exact Mass | 352.179 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 | a22b664a-b21f-41a6-9934-1bbd48ede89f |
| Package id | msbnk-fiocruz-fio00001 |
| Resource type | HTML |
| State | active |