Aurantiamide
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000716
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000716 contains the MS2 mass spectrum of Aurantiamide with the InChIkey KSVKECXWDNCRTM-GOTSBHOMSA-N.
Source: Aurantiamide
Chemical Info
| InChI | InChI=1S/C25H26N2O3/c28-18-22(16-19-10-4-1-5-11-19)26-25(30)23(17-20-12-6-2-7-13-20)27-24(29)21-14-8-3-9-15-21/h1-15,22-23,28H,16-18H2,(H,26,30)(H,27,29)/t22-,23-/m0/s1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[C@@H](CO)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3 |
| InChI Key | KSVKECXWDNCRTM-GOTSBHOMSA-N |
| Molecular Formula | C25H26N2O3 |
| Exact Mass | 402.194 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 | 2d228975-11b4-42da-a85a-25d2dbbf697a |
| Package id | msbnk-aafc-ac000716 |
| Resource type | HTML |
| State | active |