Tricoumaroyl spermidine (isomer of 2952)
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR311084
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR311084 contains the MS2 mass spectrum of Tricoumaroyl spermidine (isomer of 2952) with the InChIkey PFDVWJCSCYDRMZ-UHFFFAOYSA-N.
Chemical Info
| InChI | InChI=1S/C34H37N3O6/c38-29-13-4-26(5-14-29)10-19-32(41)35-22-1-2-24-37(34(43)21-12-28-8-17-31(40)18-9-28)25-3-23-36-33(42)20-11-27-6-15-30(39)16-7-27/h4-21,38-40H,1-3,22-25H2,(H,35,41)(H,36,42) |
|---|---|
| SMILES | O=C(C=CC1=CC=C(O)C=C1)NCCCN(C(=O)C=CC2=CC=C(O)C=C2)CCCCNC(=O)C=CC3=CC=C(O)C=C3 |
| InChI Key | PFDVWJCSCYDRMZ-UHFFFAOYSA-N |
| Molecular Formula | C34H37N3O6 |
| Exact Mass | 583.685 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 | 2fe49b32-94f9-468d-b3be-c7ad6da83abf |
| Package id | msbnk-riken-pr311084 |
| Resource type | HTML |
| State | active |